6-[6-[2-(3-ethoxyphenyl)ethyl-methyl-amino]hexanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[6-[2-(3-ethoxyphenyl)ethyl-methyl-amino]hexanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[6-[2-(3-ethoxyphenyl)ethyl-methyl-amino]hexanoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[6-[2-(3-ethoxyphenyl)ethyl-methylamino]-1-oxohexyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[6-[2-(3-ethoxyphenyl)ethyl-methylamino]hexanoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[6-[methyl(2-m-phenetylethyl)amino]hexanoyl]-4H-1,4-benzoxazin-3-one Formula: C25H32N2O4 MolecularWeight: 424.53258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CCN(C)CCCCCC(=O)C2=CC3=C(C=C2)OCC(=O)N3

Isomeric SMILES

CCOC1=CC=CC(=C1)CCN(C)CCCCCC(=O)C2=CC3=C(C=C2)OCC(=O)N3

InChI

InChI=1S/C25H32N2O4/c1-3-30-21-9-7-8-19(16-21)13-15-27(2)14-6-4-5-10-23(28)20-11-12-24-22(17-20)26-25(29)18-31-24/h7-9,11-12,16-17H,3-6,10,13-15,18H2,1-2H3,(H,26,29)