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

Systemtic Name: 3-[(2-butoxyphenyl)amino]-4-chloranyl-1-(phenylmethyl)pyrrole-2,5-dione Openeye Name: 1-benzyl-3-(2-butoxyanilino)-4-chloro-pyrrole-2,5-dione CAS Name: 3-(2-butoxyanilino)-4-chloro-1-(phenylmethyl)pyrrole-2,5-dione IUPAC Name: 1-benzyl-3-(2-butoxyanilino)-4-chloropyrrole-2,5-dione Traditional Name: 1-benzyl-3-(2-butoxyanilino)-4-chloro-3-pyrroline-2,5-quinone Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)Cl

Isomeric SMILES

CCCCOC1=CC=CC=C1NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C21H21ClN2O3/c1-2-3-13-27-17-12-8-7-11-16(17)23-19-18(22)20(25)24(21(19)26)14-15-9-5-4-6-10-15/h4-12,23H,2-3,13-14H2,1H3