6-(azepan-1-ylcarbonyl)-4-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-2,2-dimethyl-1,4-benzoxazin-3-one

Systemtic Name: 6-(azepan-1-ylcarbonyl)-4-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-2,2-dimethyl-1,4-benzoxazin-3-one Openeye Name: 6-(azepane-1-carbonyl)-4-[2-(4-chlorophenyl)-2-oxo-ethyl]-2,2-dimethyl-1,4-benzoxazin-3-one CAS Name: 6-[1-azepanyl(oxo)methyl]-4-[2-(4-chlorophenyl)-2-oxoethyl]-2,2-dimethyl-1,4-benzoxazin-3-one IUPAC Name: 6-(azepane-1-carbonyl)-4-[2-(4-chlorophenyl)-2-oxoethyl]-2,2-dimethyl-1,4-benzoxazin-3-one Traditional Name: 6-(azepane-1-carbonyl)-4-[2-(4-chlorophenyl)-2-keto-ethyl]-2,2-dimethyl-1,4-benzoxazin-3-one Formula: C25H27ClN2O4 MolecularWeight: 454.94588

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C2=C(O1)C=CC(=C2)C(=O)N3CCCCCC3)CC(=O)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1(C(=O)N(C2=C(O1)C=CC(=C2)C(=O)N3CCCCCC3)CC(=O)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C25H27ClN2O4/c1-25(2)24(31)28(16-21(29)17-7-10-19(26)11-8-17)20-15-18(9-12-22(20)32-25)23(30)27-13-5-3-4-6-14-27/h7-12,15H,3-6,13-14,16H2,1-2H3