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

Systemtic Name: 3-[(4-butylphenyl)amino]-4-chloranyl-1-(2,5-dimethoxyphenyl)pyrrole-2,5-dione Openeye Name: 3-(4-butylanilino)-4-chloro-1-(2,5-dimethoxyphenyl)pyrrole-2,5-dione CAS Name: 3-(4-butylanilino)-4-chloro-1-(2,5-dimethoxyphenyl)pyrrole-2,5-dione IUPAC Name: 3-(4-butylanilino)-4-chloro-1-(2,5-dimethoxyphenyl)pyrrole-2,5-dione Traditional Name: 3-(4-butylanilino)-4-chloro-1-(2,5-dimethoxyphenyl)-3-pyrroline-2,5-quinone Formula: C22H23ClN2O4 MolecularWeight: 414.88202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23ClN2O4/c1-4-5-6-14-7-9-15(10-8-14)24-20-19(23)21(26)25(22(20)27)17-13-16(28-2)11-12-18(17)29-3/h7-13,24H,4-6H2,1-3H3