6-[5-[2-(2-ethoxyphenyl)ethyl-methyl-amino]pentanoyl]-4H-1,4-benzoxazin-3-one hydrochloride

Systemtic Name: 6-[5-[2-(2-ethoxyphenyl)ethyl-methyl-amino]pentanoyl]-4H-1,4-benzoxazin-3-one hydrochloride Openeye Name: 6-[5-[2-(2-ethoxyphenyl)ethyl-methyl-amino]pentanoyl]-4H-1,4-benzoxazin-3-one hydrochloride CAS Name: 6-[5-[2-(2-ethoxyphenyl)ethyl-methylamino]-1-oxopentyl]-4H-1,4-benzoxazin-3-one hydrochloride IUPAC Name: 6-[5-[2-(2-ethoxyphenyl)ethyl-methylamino]pentanoyl]-4H-1,4-benzoxazin-3-one hydrochloride Traditional Name: 6-[5-[methyl(2-o-phenetylethyl)amino]pentanoyl]-4H-1,4-benzoxazin-3-one hydrochloride Formula: C24H31ClN2O4 MolecularWeight: 446.96694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CCN(C)CCCCC(=O)C2=CC3=C(C=C2)OCC(=O)N3.Cl

Isomeric SMILES

CCOC1=CC=CC=C1CCN(C)CCCCC(=O)C2=CC3=C(C=C2)OCC(=O)N3.Cl

InChI

InChI=1S/C24H30N2O4.ClH/c1-3-29-22-10-5-4-8-18(22)13-15-26(2)14-7-6-9-21(27)19-11-12-23-20(16-19)25-24(28)17-30-23;/h4-5,8,10-12,16H,3,6-7,9,13-15,17H2,1-2H3,(H,25,28);1H