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carboxy 2-[(2-azanyl-4-methyl-pentanoyl)-(4-phenylphenyl)amino]-2-methyl-5-oxidanylidene-5-phenylazanyl-pentanoate

carboxy 2-[(2-azanyl-4-methyl-pentanoyl)-(4-phenylphenyl)amino]-2-methyl-5-oxidanylidene-5-phenylazanyl-pentanoate

Systemtic Name:carboxy 2-[(2-azanyl-4-methyl-pentanoyl)-(4-phenylphenyl)amino]-2-methyl-5-oxidanylidene-5-phenylazanyl-pentanoate
Openeye Name:carboxy 2-(N-(2-amino-4-methyl-pentanoyl)-4-phenyl-anilino)-5-anilino-2-methyl-5-oxo-pentanoate
CAS Name:2-(N-(2-amino-4-methyl-1-oxopentyl)-4-phenylanilino)-5-anilino-2-methyl-5-oxopentanoic acid carboxy ester
IUPAC Name:carboxy 2-(N-(2-amino-4-methylpentanoyl)-4-phenylanilino)-5-anilino-2-methyl-5-oxopentanoate
Traditional Name:2-(N-(2-amino-4-methyl-pentanoyl)-4-phenyl-anilino)-5-anilino-5-keto-2-methyl-valeric acid carboxy ester
Formula: C31H35N3O6
MolecularWeight: 545.6261
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N(C1=CC=C(C=C1)C2=CC=CC=C2)C(C)(CCC(=O)NC3=CC=CC=C3)C(=O)OC(=O)O)N


Isomeric SMILES

CC(C)CC(C(=O)N(C1=CC=C(C=C1)C2=CC=CC=C2)C(C)(CCC(=O)NC3=CC=CC=C3)C(=O)OC(=O)O)N


InChI

InChI=1S/C31H35N3O6/c1-21(2)20-26(32)28(36)34(25-16-14-23(15-17-25)22-10-6-4-7-11-22)31(3,29(37)40-30(38)39)19-18-27(35)33-24-12-8-5-9-13-24/h4-17,21,26H,18-20,32H2,1-3H3,(H,33,35)(H,38,39)


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