3-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-2-(4-chlorophenyl)-7-methyl-chromen-4-one

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-2-(4-chlorophenyl)-7-methyl-chromen-4-one Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethoxy]-2-(4-chlorophenyl)-7-methyl-chromen-4-one CAS Name: 3-[2-(1-azepanyl)-2-oxoethoxy]-2-(4-chlorophenyl)-7-methyl-1-benzopyran-4-one IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethoxy]-2-(4-chlorophenyl)-7-methylchromen-4-one Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethoxy]-2-(4-chlorophenyl)-7-methyl-chromone Formula: C24H24ClNO4 MolecularWeight: 425.90466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)Cl)OCC(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)Cl)OCC(=O)N4CCCCCC4

InChI

InChI=1S/C24H24ClNO4/c1-16-6-11-19-20(14-16)30-23(17-7-9-18(25)10-8-17)24(22(19)28)29-15-21(27)26-12-4-2-3-5-13-26/h6-11,14H,2-5,12-13,15H2,1H3