methyl 3-[[(E)-2-(2-chloranylpyridin-3-yl)carbonyl-3-ethoxy-3-oxidanylidene-prop-1-enyl]amino]azetidine-1-carboxylate

Systemtic Name: methyl 3-[[(E)-2-(2-chloranylpyridin-3-yl)carbonyl-3-ethoxy-3-oxidanylidene-prop-1-enyl]amino]azetidine-1-carboxylate Openeye Name: methyl 3-[[(E)-2-(2-chloropyridine-3-carbonyl)-3-ethoxy-3-oxo-prop-1-enyl]amino]azetidine-1-carboxylate CAS Name: 3-[[(E)-2-[(2-chloro-3-pyridinyl)-oxomethyl]-3-ethoxy-3-oxoprop-1-enyl]amino]-1-azetidinecarboxylic acid methyl ester IUPAC Name: methyl 3-[[(E)-2-(2-chloropyridine-3-carbonyl)-3-ethoxy-3-oxoprop-1-enyl]amino]azetidine-1-carboxylate Traditional Name: 3-[[(E)-2-carbethoxy-3-(2-chloro-3-pyridyl)-3-keto-prop-1-enyl]amino]azetidine-1-carboxylic acid methyl ester Formula: C16H18ClN3O5 MolecularWeight: 367.78422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1CN(C1)C(=O)OC)C(=O)C2=C(N=CC=C2)Cl

Isomeric SMILES

CCOC(=O)/C(=C/NC1CN(C1)C(=O)OC)/C(=O)C2=C(N=CC=C2)Cl

InChI

InChI=1S/C16H18ClN3O5/c1-3-25-15(22)12(13(21)11-5-4-6-18-14(11)17)7-19-10-8-20(9-10)16(23)24-2/h4-7,10,19H,3,8-9H2,1-2H3/b12-7+