1-(4-butylphenyl)-3-chloranyl-4-[(4-ethanoylphenyl)amino]pyrrole-2,5-dione

Systemtic Name: 1-(4-butylphenyl)-3-chloranyl-4-[(4-ethanoylphenyl)amino]pyrrole-2,5-dione Openeye Name: 3-(4-acetylanilino)-1-(4-butylphenyl)-4-chloro-pyrrole-2,5-dione CAS Name: 3-(4-acetylanilino)-1-(4-butylphenyl)-4-chloropyrrole-2,5-dione IUPAC Name: 3-(4-acetylanilino)-1-(4-butylphenyl)-4-chloropyrrole-2,5-dione Traditional Name: 3-(4-acetylanilino)-1-(4-butylphenyl)-4-chloro-3-pyrroline-2,5-quinone Formula: C22H21ClN2O3 MolecularWeight: 396.86674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)NC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)NC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C22H21ClN2O3/c1-3-4-5-15-6-12-18(13-7-15)25-21(27)19(23)20(22(25)28)24-17-10-8-16(9-11-17)14(2)26/h6-13,24H,3-5H2,1-2H3