[4-ethanoyl-2-methyl-1-[methyl(phenyl)amino]-5-(4-nitrophenyl)pyrrol-3-yl] ethanoate

Systemtic Name: [4-ethanoyl-2-methyl-1-[methyl(phenyl)amino]-5-(4-nitrophenyl)pyrrol-3-yl] ethanoate Openeye Name: [4-acetyl-2-methyl-1-(N-methylanilino)-5-(4-nitrophenyl)pyrrol-3-yl] acetate CAS Name: acetic acid [4-acetyl-2-methyl-1-(N-methylanilino)-5-(4-nitrophenyl)-3-pyrrolyl] ester IUPAC Name: [4-acetyl-2-methyl-1-(N-methylanilino)-5-(4-nitrophenyl)pyrrol-3-yl] acetate Traditional Name: acetic acid [4-acetyl-2-methyl-1-(N-methylanilino)-5-(4-nitrophenyl)pyrrol-3-yl] ester Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1N(C)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C)OC(=O)C

Isomeric SMILES

CC1=C(C(=C(N1N(C)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C)OC(=O)C

InChI

InChI=1S/C22H21N3O5/c1-14-22(30-16(3)27)20(15(2)26)21(17-10-12-19(13-11-17)25(28)29)24(14)23(4)18-8-6-5-7-9-18/h5-13H,1-4H3