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

Systemtic Name: 3-[(4-butylphenyl)amino]-4-chloranyl-1-phenethyl-pyrrole-2,5-dione Openeye Name: 3-(4-butylanilino)-4-chloro-1-phenethyl-pyrrole-2,5-dione CAS Name: 3-(4-butylanilino)-4-chloro-1-phenethylpyrrole-2,5-dione IUPAC Name: 3-(4-butylanilino)-4-chloro-1-phenethylpyrrole-2,5-dione Traditional Name: 3-(4-butylanilino)-4-chloro-1-phenethyl-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)CCC3=CC=CC=C3)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)Cl

InChI

InChI=1S/C22H23ClN2O2/c1-2-3-7-17-10-12-18(13-11-17)24-20-19(23)21(26)25(22(20)27)15-14-16-8-5-4-6-9-16/h4-6,8-13,24H,2-3,7,14-15H2,1H3