3-(azepan-1-yl)-1-(4-chlorophenyl)pyrrole-2,5-dione

Systemtic Name: 3-(azepan-1-yl)-1-(4-chlorophenyl)pyrrole-2,5-dione Openeye Name: 3-(azepan-1-yl)-1-(4-chlorophenyl)pyrrole-2,5-dione CAS Name: 3-(1-azepanyl)-1-(4-chlorophenyl)pyrrole-2,5-dione IUPAC Name: 3-(azepan-1-yl)-1-(4-chlorophenyl)pyrrole-2,5-dione Traditional Name: 3-(azepan-1-yl)-1-(4-chlorophenyl)-3-pyrroline-2,5-quinone Formula: C16H17ClN2O2 MolecularWeight: 304.77138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=O)N(C2=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCCN(CC1)C2=CC(=O)N(C2=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H17ClN2O2/c17-12-5-7-13(8-6-12)19-15(20)11-14(16(19)21)18-9-3-1-2-4-10-18/h5-8,11H,1-4,9-10H2