4-(butylaminomethyl)-3-(4-chloranylphenoxy)-1-(2-methylphenyl)azetidin-2-one hydrochloride

Systemtic Name: 4-(butylaminomethyl)-3-(4-chloranylphenoxy)-1-(2-methylphenyl)azetidin-2-one hydrochloride Openeye Name: 4-(butylaminomethyl)-3-(4-chlorophenoxy)-1-(o-tolyl)azetidin-2-one hydrochloride CAS Name: 4-(butylaminomethyl)-3-(4-chlorophenoxy)-1-(2-methylphenyl)-2-azetidinone hydrochloride IUPAC Name: 4-(butylaminomethyl)-3-(4-chlorophenoxy)-1-(2-methylphenyl)azetidin-2-one hydrochloride Traditional Name: 4-(butylaminomethyl)-3-(4-chlorophenoxy)-1-(o-tolyl)azetidin-2-one hydrochloride Formula: C21H26Cl2N2O2 MolecularWeight: 409.34934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1C(C(=O)N1C2=CC=CC=C2C)OC3=CC=C(C=C3)Cl.Cl

Isomeric SMILES

CCCCNCC1C(C(=O)N1C2=CC=CC=C2C)OC3=CC=C(C=C3)Cl.Cl

InChI

InChI=1S/C21H25ClN2O2.ClH/c1-3-4-13-23-14-19-20(26-17-11-9-16(22)10-12-17)21(25)24(19)18-8-6-5-7-15(18)2;/h5-12,19-20,23H,3-4,13-14H2,1-2H3;1H