2-methylpropyl (3Z)-3-azanyl-2-[benzamido(pentanoyl)amino]-2-methyl-3-phenylmethoxycarbonylimino-propanoate

Systemtic Name: 2-methylpropyl (3Z)-3-azanyl-2-[benzamido(pentanoyl)amino]-2-methyl-3-phenylmethoxycarbonylimino-propanoate Openeye Name: isobutyl (3Z)-3-amino-2-[benzamido(pentanoyl)amino]-3-benzyloxycarbonylimino-2-methyl-propanoate CAS Name: (3Z)-3-amino-2-[benzamido(1-oxopentyl)amino]-2-methyl-3-phenylmethoxycarbonyliminopropanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (3Z)-3-amino-2-[benzamido(pentanoyl)amino]-2-methyl-3-phenylmethoxycarbonyliminopropanoate Traditional Name: (3Z)-3-amino-2-[benzamido(valeryl)amino]-3-carbobenzoxyimino-2-methyl-propionic acid isobutyl ester Formula: C28H36N4O6 MolecularWeight: 524.60864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(C(C)(C(=NC(=O)OCC1=CC=CC=C1)N)C(=O)OCC(C)C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC(=O)N(C(C)(/C(=N/C(=O)OCC1=CC=CC=C1)/N)C(=O)OCC(C)C)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C28H36N4O6/c1-5-6-17-23(33)32(31-24(34)22-15-11-8-12-16-22)28(4,26(35)37-18-20(2)3)25(29)30-27(36)38-19-21-13-9-7-10-14-21/h7-16,20H,5-6,17-19H2,1-4H3,(H,31,34)(H2,29,30,36)