(phenylmethyl) (3S)-5-chloranyl-3-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]-4-oxidanylidene-pentanoate

Systemtic Name: (phenylmethyl) (3S)-5-chloranyl-3-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]-4-oxidanylidene-pentanoate Openeye Name: benzyl (3S)-3-[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]-5-chloro-4-oxo-pentanoate CAS Name: (3S)-5-chloro-3-[[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]-4-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (3S)-5-chloro-3-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]-4-oxopentanoate Traditional Name: (3S)-3-[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]-5-chloro-4-keto-valeric acid benzyl ester Formula: C26H31ClN2O6 MolecularWeight: 502.98714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC(=O)OCC2=CC=CC=C2)C(=O)CCl

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(=O)OCC2=CC=CC=C2)C(=O)CCl

InChI

InChI=1S/C26H31ClN2O6/c1-26(2,3)35-25(33)29-21(14-18-10-6-4-7-11-18)24(32)28-20(22(30)16-27)15-23(31)34-17-19-12-8-5-9-13-19/h4-13,20-21H,14-17H2,1-3H3,(H,28,32)(H,29,33)/t20-,21-/m0/s1