6-(azepan-1-ylcarbonyl)-2,2-dimethyl-4-phenethyl-1,4-benzoxazin-3-one

Systemtic Name: 6-(azepan-1-ylcarbonyl)-2,2-dimethyl-4-phenethyl-1,4-benzoxazin-3-one Openeye Name: 6-(azepane-1-carbonyl)-2,2-dimethyl-4-phenethyl-1,4-benzoxazin-3-one CAS Name: 6-[1-azepanyl(oxo)methyl]-2,2-dimethyl-4-phenethyl-1,4-benzoxazin-3-one IUPAC Name: 6-(azepane-1-carbonyl)-2,2-dimethyl-4-phenethyl-1,4-benzoxazin-3-one Traditional Name: 6-(azepane-1-carbonyl)-2,2-dimethyl-4-phenethyl-1,4-benzoxazin-3-one Formula: C25H30N2O3 MolecularWeight: 406.5173

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C2=C(O1)C=CC(=C2)C(=O)N3CCCCCC3)CCC4=CC=CC=C4)C

Isomeric SMILES

CC1(C(=O)N(C2=C(O1)C=CC(=C2)C(=O)N3CCCCCC3)CCC4=CC=CC=C4)C

InChI

InChI=1S/C25H30N2O3/c1-25(2)24(29)27(17-14-19-10-6-5-7-11-19)21-18-20(12-13-22(21)30-25)23(28)26-15-8-3-4-9-16-26/h5-7,10-13,18H,3-4,8-9,14-17H2,1-2H3