ethyl 4-[[2-[(2-azanyl-4-oxidanyl-4-phenylmethoxy-butanoyl)amino]-4-methyl-pentanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-[(2-azanyl-4-oxidanyl-4-phenylmethoxy-butanoyl)amino]-4-methyl-pentanoyl]amino]benzoate Openeye Name: ethyl 4-[[2-[(2-amino-4-benzyloxy-4-hydroxy-butanoyl)amino]-4-methyl-pentanoyl]amino]benzoate CAS Name: 4-[[2-[(2-amino-4-hydroxy-1-oxo-4-phenylmethoxybutyl)amino]-4-methyl-1-oxopentyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(2-amino-4-hydroxy-4-phenylmethoxybutanoyl)amino]-4-methylpentanoyl]amino]benzoate Traditional Name: 4-[[2-[(2-amino-4-benzoxy-4-hydroxy-butanoyl)amino]-4-methyl-pentanoyl]amino]benzoic acid ethyl ester Formula: C26H35N3O6 MolecularWeight: 485.5726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC(C)C)NC(=O)C(CC(O)OCC2=CC=CC=C2)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC(C)C)NC(=O)C(CC(O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C26H35N3O6/c1-4-34-26(33)19-10-12-20(13-11-19)28-25(32)22(14-17(2)3)29-24(31)21(27)15-23(30)35-16-18-8-6-5-7-9-18/h5-13,17,21-23,30H,4,14-16,27H2,1-3H3,(H,28,32)(H,29,31)