methyl (2S)-4-methyl-2-[[2-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-3-oxidanylidene-3-phenylmethoxy-propanoyl]amino]pentanoate

Systemtic Name: methyl (2S)-4-methyl-2-[[2-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-3-oxidanylidene-3-phenylmethoxy-propanoyl]amino]pentanoate Openeye Name: methyl (2S)-2-[[3-benzyloxy-2-[[(2S)-2-(tert-butoxycarbonylamino)-4-methyl-pentanoyl]amino]-3-oxo-propanoyl]amino]-4-methyl-pentanoate CAS Name: (2S)-4-methyl-2-[[2-[[(2S)-4-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopentyl]amino]-1,3-dioxo-3-phenylmethoxypropyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2S)-4-methyl-2-[[2-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-3-oxo-3-phenylmethoxypropanoyl]amino]pentanoate Traditional Name: (2S)-2-[[3-benzoxy-2-[[(2S)-2-(tert-butoxycarbonylamino)-4-methyl-pentanoyl]amino]-3-keto-propanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C28H43N3O8 MolecularWeight: 549.65632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C(=O)NC(CC(C)C)C(=O)OC)C(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC(C(=O)N[C@@H](CC(C)C)C(=O)OC)C(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C28H43N3O8/c1-17(2)14-20(30-27(36)39-28(5,6)7)23(32)31-22(26(35)38-16-19-12-10-9-11-13-19)24(33)29-21(15-18(3)4)25(34)37-8/h9-13,17-18,20-22H,14-16H2,1-8H3,(H,29,33)(H,30,36)(H,31,32)/t20-,21-,22?/m0/s1