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

Systemtic Name: 3-[(4-butylphenyl)amino]-4-chloranyl-1-(2,3-dimethylphenyl)pyrrole-2,5-dione Openeye Name: 3-(4-butylanilino)-4-chloro-1-(2,3-dimethylphenyl)pyrrole-2,5-dione CAS Name: 3-(4-butylanilino)-4-chloro-1-(2,3-dimethylphenyl)pyrrole-2,5-dione IUPAC Name: 3-(4-butylanilino)-4-chloro-1-(2,3-dimethylphenyl)pyrrole-2,5-dione Traditional Name: 3-(4-butylanilino)-4-chloro-1-(2,3-dimethylphenyl)-3-pyrroline-2,5-quinone Formula: C22H23ClN2O2 MolecularWeight: 382.88322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)C3=CC=CC(=C3C)C)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)C3=CC=CC(=C3C)C)Cl

InChI

InChI=1S/C22H23ClN2O2/c1-4-5-8-16-10-12-17(13-11-16)24-20-19(23)21(26)25(22(20)27)18-9-6-7-14(2)15(18)3/h6-7,9-13,24H,4-5,8H2,1-3H3