ethyl 5-methyl-3-[(4-nitrophenyl)-phenylazanyl-methyl]-2-oxidanylidene-1,3-dihydropyrrole-4-carboxylate

Systemtic Name: ethyl 5-methyl-3-[(4-nitrophenyl)-phenylazanyl-methyl]-2-oxidanylidene-1,3-dihydropyrrole-4-carboxylate Openeye Name: ethyl 3-[anilino-(4-nitrophenyl)methyl]-5-methyl-2-oxo-1,3-dihydropyrrole-4-carboxylate CAS Name: 3-[anilino-(4-nitrophenyl)methyl]-5-methyl-2-oxo-1,3-dihydropyrrole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[anilino-(4-nitrophenyl)methyl]-5-methyl-2-oxo-1,3-dihydropyrrole-4-carboxylate Traditional Name: 4-[anilino-(4-nitrophenyl)methyl]-5-keto-2-methyl-2-pyrroline-3-carboxylic acid ethyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)C1C(C2=CC=C(C=C2)[N+](=O)[O-])NC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)C1C(C2=CC=C(C=C2)[N+](=O)[O-])NC3=CC=CC=C3)C

InChI

InChI=1S/C21H21N3O5/c1-3-29-21(26)17-13(2)22-20(25)18(17)19(23-15-7-5-4-6-8-15)14-9-11-16(12-10-14)24(27)28/h4-12,18-19,23H,3H2,1-2H3,(H,22,25)