methyl (3S)-3-[(3,5-diacetamidophenyl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (3S)-3-[(3,5-diacetamidophenyl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (3S)-3-[(3,5-diacetamidobenzoyl)amino]-3-phenyl-propanoate CAS Name: (3S)-3-[[(3,5-diacetamidophenyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (3S)-3-[(3,5-diacetamidobenzoyl)amino]-3-phenylpropanoate Traditional Name: (3S)-3-[(3,5-diacetamidobenzoyl)amino]-3-phenyl-propionic acid methyl ester Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)C(=O)NC(CC(=O)OC)C2=CC=CC=C2)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)C(=O)N[C@@H](CC(=O)OC)C2=CC=CC=C2)NC(=O)C

InChI

InChI=1S/C21H23N3O5/c1-13(25)22-17-9-16(10-18(11-17)23-14(2)26)21(28)24-19(12-20(27)29-3)15-7-5-4-6-8-15/h4-11,19H,12H2,1-3H3,(H,22,25)(H,23,26)(H,24,28)/t19-/m0/s1