3-[1-[(3-methylphenyl)carbonylamino]-5-phenyl-pyrrol-2-yl]propanoate

Systemtic Name: 3-[1-[(3-methylphenyl)carbonylamino]-5-phenyl-pyrrol-2-yl]propanoate Openeye Name: 3-[1-[(3-methylbenzoyl)amino]-5-phenyl-pyrrol-2-yl]propanoate CAS Name: 3-[1-[[(3-methylphenyl)-oxomethyl]amino]-5-phenyl-2-pyrrolyl]propanoate IUPAC Name: 3-[1-[(3-methylbenzoyl)amino]-5-phenylpyrrol-2-yl]propanoate Traditional Name: 3-[1-(m-toluoylamino)-5-phenyl-pyrrol-2-yl]propionate Formula: C21H19N2O3- MolecularWeight: 347.38716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NN2C(=CC=C2C3=CC=CC=C3)CCC(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NN2C(=CC=C2C3=CC=CC=C3)CCC(=O)[O-]

InChI

InChI=1S/C21H20N2O3/c1-15-6-5-9-17(14-15)21(26)22-23-18(11-13-20(24)25)10-12-19(23)16-7-3-2-4-8-16/h2-10,12,14H,11,13H2,1H3,(H,22,26)(H,24,25)/p-1