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

Systemtic Name: 3-[(4-butylphenyl)amino]-4-chloranyl-1-(3-methoxyphenyl)pyrrole-2,5-dione Openeye Name: 3-(4-butylanilino)-4-chloro-1-(3-methoxyphenyl)pyrrole-2,5-dione CAS Name: 3-(4-butylanilino)-4-chloro-1-(3-methoxyphenyl)pyrrole-2,5-dione IUPAC Name: 3-(4-butylanilino)-4-chloro-1-(3-methoxyphenyl)pyrrole-2,5-dione Traditional Name: 3-(4-butylanilino)-4-chloro-1-(3-methoxyphenyl)-3-pyrroline-2,5-quinone Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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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=C3)OC)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN2O3/c1-3-4-6-14-9-11-15(12-10-14)23-19-18(22)20(25)24(21(19)26)16-7-5-8-17(13-16)27-2/h5,7-13,23H,3-4,6H2,1-2H3