ethyl (E,4S)-4-[[(2S)-2-[[(2S)-2,3-bis[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-4-methyl-pentanoyl]amino]-5-[(3S)-2-oxidanylidenepyrrolidin-3-yl]pent-2-enoate

Systemtic Name: ethyl (E,4S)-4-[[(2S)-2-[[(2S)-2,3-bis[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-4-methyl-pentanoyl]amino]-5-[(3S)-2-oxidanylidenepyrrolidin-3-yl]pent-2-enoate Openeye Name: ethyl (E,4S)-4-[[(2S)-2-[[(2S)-2,3-bis(tert-butoxycarbonylamino)propanoyl]amino]-4-methyl-pentanoyl]amino]-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoate CAS Name: (E,4S)-4-[[(2S)-2-[[(2S)-2,3-bis[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]-4-methyl-1-oxopentyl]amino]-5-[(3S)-2-oxo-3-pyrrolidinyl]-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E,4S)-4-[[(2S)-2-[[(2S)-2,3-bis[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-4-methylpentanoyl]amino]-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoate Traditional Name: (E,4S)-4-[[(2S)-2-[[(2S)-2,3-bis(tert-butoxycarbonylamino)propanoyl]amino]-4-methyl-pentanoyl]amino]-5-[(3S)-2-ketopyrrolidin-3-yl]pent-2-enoic acid ethyl ester Formula: C30H51N5O9 MolecularWeight: 625.75404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CC1CCNC1=O)NC(=O)C(CC(C)C)NC(=O)C(CNC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)/C=C/[C@H](C[C@@H]1CCNC1=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CNC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C30H51N5O9/c1-10-42-23(36)12-11-20(16-19-13-14-31-24(19)37)33-25(38)21(15-18(2)3)34-26(39)22(35-28(41)44-30(7,8)9)17-32-27(40)43-29(4,5)6/h11-12,18-22H,10,13-17H2,1-9H3,(H,31,37)(H,32,40)(H,33,38)(H,34,39)(H,35,41)/b12-11+/t19-,20+,21-,22-/m0/s1