tert-butyl 2-[4-oxidanylidene-3-(phenylmethoxycarbonylamino)azetidin-2-yl]ethanoate; ethanal

Systemtic Name: tert-butyl 2-[4-oxidanylidene-3-(phenylmethoxycarbonylamino)azetidin-2-yl]ethanoate; ethanal Openeye Name: acetaldehyde; tert-butyl 2-[3-(benzyloxycarbonylamino)-4-oxo-azetidin-2-yl]acetate CAS Name: acetaldehyde; 2-[4-oxo-3-(phenylmethoxycarbonylamino)-2-azetidinyl]acetic acid tert-butyl ester IUPAC Name: acetaldehyde; tert-butyl 2-[4-oxo-3-(phenylmethoxycarbonylamino)azetidin-2-yl]acetate Traditional Name: acetaldehyde; 2-[3-(benzyloxycarbonylamino)-4-keto-azetidin-2-yl]acetic acid tert-butyl ester Formula: C19H26N2O6 MolecularWeight: 378.41954

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Descriptors Computed from Structure

Canonical SMILES:

CC=O.CC(C)(C)OC(=O)CC1C(C(=O)N1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC=O.CC(C)(C)OC(=O)CC1C(C(=O)N1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H22N2O5.C2H4O/c1-17(2,3)24-13(20)9-12-14(15(21)18-12)19-16(22)23-10-11-7-5-4-6-8-11;1-2-3/h4-8,12,14H,9-10H2,1-3H3,(H,18,21)(H,19,22);2H,1H3