11-chloranyl-4-(3-methoxyphenyl)carbonyl-2,5,6,7-tetrahydro-1H-4-benzazecine-3,8-dione

Systemtic Name: 11-chloranyl-4-(3-methoxyphenyl)carbonyl-2,5,6,7-tetrahydro-1H-4-benzazecine-3,8-dione Openeye Name: 11-chloro-4-(3-methoxybenzoyl)-2,5,6,7-tetrahydro-1H-4-benzazecine-3,8-dione CAS Name: 11-chloro-4-[(3-methoxyphenyl)-oxomethyl]-2,5,6,7-tetrahydro-1H-4-benzazecine-3,8-dione IUPAC Name: 11-chloro-4-(3-methoxybenzoyl)-2,5,6,7-tetrahydro-1H-4-benzazecine-3,8-dione Traditional Name: 11-chloro-4-m-anisoyl-2,5,6,7-tetrahydro-1H-4-benzazecine-3,8-quinone Formula: C21H20ClNO4 MolecularWeight: 385.8408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCCC(=O)C3=C(CCC2=O)C=C(C=C3)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCCC(=O)C3=C(CCC2=O)C=C(C=C3)Cl

InChI

InChI=1S/C21H20ClNO4/c1-27-17-5-2-4-15(13-17)21(26)23-11-3-6-19(24)18-9-8-16(22)12-14(18)7-10-20(23)25/h2,4-5,8-9,12-13H,3,6-7,10-11H2,1H3