(6-methylpyridin-3-yl)methyl 3,5-bis(azanyl)-6-methyl-4-oxidanylidene-2-(1-oxidanyl-4-phenyl-butyl)-3-phenyl-heptanoate

Systemtic Name: (6-methylpyridin-3-yl)methyl 3,5-bis(azanyl)-6-methyl-4-oxidanylidene-2-(1-oxidanyl-4-phenyl-butyl)-3-phenyl-heptanoate Openeye Name: (6-methyl-3-pyridyl)methyl 3,5-diamino-2-(1-hydroxy-4-phenyl-butyl)-6-methyl-4-oxo-3-phenyl-heptanoate CAS Name: 3,5-diamino-2-(1-hydroxy-4-phenylbutyl)-6-methyl-4-oxo-3-phenylheptanoic acid (6-methyl-3-pyridinyl)methyl ester IUPAC Name: (6-methylpyridin-3-yl)methyl 3,5-diamino-2-(1-hydroxy-4-phenylbutyl)-6-methyl-4-oxo-3-phenylheptanoate Traditional Name: 3,5-diamino-2-(1-hydroxy-4-phenyl-butyl)-4-keto-6-methyl-3-phenyl-enanthic acid (6-methyl-3-pyridyl)methyl ester Formula: C31H39N3O4 MolecularWeight: 517.65906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)COC(=O)C(C(CCCC2=CC=CC=C2)O)C(C3=CC=CC=C3)(C(=O)C(C(C)C)N)N

Isomeric SMILES

CC1=NC=C(C=C1)COC(=O)C(C(CCCC2=CC=CC=C2)O)C(C3=CC=CC=C3)(C(=O)C(C(C)C)N)N

InChI

InChI=1S/C31H39N3O4/c1-21(2)28(32)29(36)31(33,25-14-8-5-9-15-25)27(26(35)16-10-13-23-11-6-4-7-12-23)30(37)38-20-24-18-17-22(3)34-19-24/h4-9,11-12,14-15,17-19,21,26-28,35H,10,13,16,20,32-33H2,1-3H3