methyl (2S)-2-[(5-ethanoyl-1H-pyrrol-2-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[(5-ethanoyl-1H-pyrrol-2-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(5-acetyl-1H-pyrrole-2-carbonyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(5-acetyl-1H-pyrrol-2-yl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(5-acetyl-1H-pyrrole-2-carbonyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(5-acetyl-1H-pyrrole-2-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(N1)C(=O)NC(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(=O)C1=CC=C(N1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C17H18N2O4/c1-11(20)13-8-9-14(18-13)16(21)19-15(17(22)23-2)10-12-6-4-3-5-7-12/h3-9,15,18H,10H2,1-2H3,(H,19,21)/t15-/m0/s1