[4-(3-azanyl-4-ethanoyl-5-methyl-1H-pyrrol-2-yl)phenyl] benzoate

Systemtic Name: [4-(3-azanyl-4-ethanoyl-5-methyl-1H-pyrrol-2-yl)phenyl] benzoate Openeye Name: [4-(4-acetyl-3-amino-5-methyl-1H-pyrrol-2-yl)phenyl] benzoate CAS Name: benzoic acid [4-(4-acetyl-3-amino-5-methyl-1H-pyrrol-2-yl)phenyl] ester IUPAC Name: [4-(4-acetyl-3-amino-5-methyl-1H-pyrrol-2-yl)phenyl] benzoate Traditional Name: benzoic acid [4-(4-acetyl-3-amino-5-methyl-1H-pyrrol-2-yl)phenyl] ester Formula: C20H18N2O3 MolecularWeight: 334.36852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3)N)C(=O)C

Isomeric SMILES

CC1=C(C(=C(N1)C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3)N)C(=O)C

InChI

InChI=1S/C20H18N2O3/c1-12-17(13(2)23)18(21)19(22-12)14-8-10-16(11-9-14)25-20(24)15-6-4-3-5-7-15/h3-11,22H,21H2,1-2H3