methyl 3-[(4-chloranyl-1H-pyrrol-2-yl)carbonylamino]-3-(4-methylphenyl)propanoate

Systemtic Name: methyl 3-[(4-chloranyl-1H-pyrrol-2-yl)carbonylamino]-3-(4-methylphenyl)propanoate Openeye Name: methyl 3-[(4-chloro-1H-pyrrole-2-carbonyl)amino]-3-(p-tolyl)propanoate CAS Name: 3-[[(4-chloro-1H-pyrrol-2-yl)-oxomethyl]amino]-3-(4-methylphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-[(4-chloro-1H-pyrrole-2-carbonyl)amino]-3-(4-methylphenyl)propanoate Traditional Name: 3-[(4-chloro-1H-pyrrole-2-carbonyl)amino]-3-(p-tolyl)propionic acid methyl ester Formula: C16H17ClN2O3 MolecularWeight: 320.77078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)C2=CC(=CN2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)C2=CC(=CN2)Cl

InChI

InChI=1S/C16H17ClN2O3/c1-10-3-5-11(6-4-10)13(8-15(20)22-2)19-16(21)14-7-12(17)9-18-14/h3-7,9,13,18H,8H2,1-2H3,(H,19,21)