(phenylmethyl) 2-(3-azanyl-2-oxidanylidene-azetidin-1-yl)-2-(4-phenylmethoxyphenyl)ethanoate hydrochloride

Systemtic Name: (phenylmethyl) 2-(3-azanyl-2-oxidanylidene-azetidin-1-yl)-2-(4-phenylmethoxyphenyl)ethanoate hydrochloride Openeye Name: benzyl 2-(3-amino-2-oxo-azetidin-1-yl)-2-(4-benzyloxyphenyl)acetate hydrochloride CAS Name: 2-(3-amino-2-oxo-1-azetidinyl)-2-(4-phenylmethoxyphenyl)acetic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl 2-(3-amino-2-oxoazetidin-1-yl)-2-(4-phenylmethoxyphenyl)acetate hydrochloride Traditional Name: 2-(3-amino-2-keto-azetidin-1-yl)-2-(4-benzoxyphenyl)acetic acid benzyl ester hydrochloride Formula: C25H25ClN2O4 MolecularWeight: 452.93

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N1C(C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4)N.Cl

Isomeric SMILES

C1C(C(=O)N1C(C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4)N.Cl

InChI

InChI=1S/C25H24N2O4.ClH/c26-22-15-27(24(22)28)23(25(29)31-17-19-9-5-2-6-10-19)20-11-13-21(14-12-20)30-16-18-7-3-1-4-8-18;/h1-14,22-23H,15-17,26H2;1H