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

Systemtic Name: 3-(azepan-1-yl)-4-chloranyl-1-(4-methoxyphenyl)pyrrole-2,5-dione Openeye Name: 3-(azepan-1-yl)-4-chloro-1-(4-methoxyphenyl)pyrrole-2,5-dione CAS Name: 3-(1-azepanyl)-4-chloro-1-(4-methoxyphenyl)pyrrole-2,5-dione IUPAC Name: 3-(azepan-1-yl)-4-chloro-1-(4-methoxyphenyl)pyrrole-2,5-dione Traditional Name: 3-(azepan-1-yl)-4-chloro-1-(4-methoxyphenyl)-3-pyrroline-2,5-quinone Formula: C17H19ClN2O3 MolecularWeight: 334.79736

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)N3CCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)N3CCCCCC3

InChI

InChI=1S/C17H19ClN2O3/c1-23-13-8-6-12(7-9-13)20-16(21)14(18)15(17(20)22)19-10-4-2-3-5-11-19/h6-9H,2-5,10-11H2,1H3