propan-2-yl 2-[[2-[(4-butylphenyl)carbonylamino]-3-methyl-butanoyl]amino]-3-phenyl-propanoate

Systemtic Name: propan-2-yl 2-[[2-[(4-butylphenyl)carbonylamino]-3-methyl-butanoyl]amino]-3-phenyl-propanoate Openeye Name: isopropyl 2-[[2-[(4-butylbenzoyl)amino]-3-methyl-butanoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[2-[[(4-butylphenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[2-[(4-butylbenzoyl)amino]-3-methylbutanoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-[(4-butylbenzoyl)amino]-3-methyl-butanoyl]amino]-3-phenyl-propionic acid isopropyl ester Formula: C28H38N2O4 MolecularWeight: 466.61232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)NC(CC2=CC=CC=C2)C(=O)OC(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)NC(CC2=CC=CC=C2)C(=O)OC(C)C

InChI

InChI=1S/C28H38N2O4/c1-6-7-11-21-14-16-23(17-15-21)26(31)30-25(19(2)3)27(32)29-24(28(33)34-20(4)5)18-22-12-9-8-10-13-22/h8-10,12-17,19-20,24-25H,6-7,11,18H2,1-5H3,(H,29,32)(H,30,31)