3-[[3-(azepan-1-ylcarbonyl)phenyl]amino]-4-chloranyl-1-phenyl-pyrrole-2,5-dione

Systemtic Name: 3-[[3-(azepan-1-ylcarbonyl)phenyl]amino]-4-chloranyl-1-phenyl-pyrrole-2,5-dione Openeye Name: 3-[3-(azepane-1-carbonyl)anilino]-4-chloro-1-phenyl-pyrrole-2,5-dione CAS Name: 3-[3-[1-azepanyl(oxo)methyl]anilino]-4-chloro-1-phenylpyrrole-2,5-dione IUPAC Name: 3-[3-(azepane-1-carbonyl)anilino]-4-chloro-1-phenylpyrrole-2,5-dione Traditional Name: 3-[3-(azepane-1-carbonyl)anilino]-4-chloro-1-phenyl-3-pyrroline-2,5-quinone Formula: C23H22ClN3O3 MolecularWeight: 423.89208

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC(=CC=C2)NC3=C(C(=O)N(C3=O)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC(=CC=C2)NC3=C(C(=O)N(C3=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C23H22ClN3O3/c24-19-20(23(30)27(22(19)29)18-11-4-3-5-12-18)25-17-10-8-9-16(15-17)21(28)26-13-6-1-2-7-14-26/h3-5,8-12,15,25H,1-2,6-7,13-14H2