methyl 2,4-dimethyl-5-[(4-phenylazanylphenyl)carbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[(4-phenylazanylphenyl)carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[(4-anilinophenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(4-anilinoanilino)-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[(4-anilinophenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(4-anilinophenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3/c1-13-18(21(26)27-3)14(2)22-19(13)20(25)24-17-11-9-16(10-12-17)23-15-7-5-4-6-8-15/h4-12,22-23H,1-3H3,(H,24,25)