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

Systemtic Name: 3-[(4-butylphenyl)amino]-4-chloranyl-1-(phenylmethyl)pyrrole-2,5-dione Openeye Name: 1-benzyl-3-(4-butylanilino)-4-chloro-pyrrole-2,5-dione CAS Name: 3-(4-butylanilino)-4-chloro-1-(phenylmethyl)pyrrole-2,5-dione IUPAC Name: 1-benzyl-3-(4-butylanilino)-4-chloropyrrole-2,5-dione Traditional Name: 1-benzyl-3-(4-butylanilino)-4-chloro-3-pyrroline-2,5-quinone Formula: C21H21ClN2O2 MolecularWeight: 368.85664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C21H21ClN2O2/c1-2-3-7-15-10-12-17(13-11-15)23-19-18(22)20(25)24(21(19)26)14-16-8-5-4-6-9-16/h4-6,8-13,23H,2-3,7,14H2,1H3