methyl 3-[1-(chloromethyl)cyclopropyl]-3-(3,4-dihydroisoquinolin-1-yl)-2-oxidanylidene-propanoate

Systemtic Name: methyl 3-[1-(chloromethyl)cyclopropyl]-3-(3,4-dihydroisoquinolin-1-yl)-2-oxidanylidene-propanoate Openeye Name: methyl 3-[1-(chloromethyl)cyclopropyl]-3-(3,4-dihydroisoquinolin-1-yl)-2-oxo-propanoate CAS Name: 3-[1-(chloromethyl)cyclopropyl]-3-(3,4-dihydroisoquinolin-1-yl)-2-oxopropanoic acid methyl ester IUPAC Name: methyl 3-[1-(chloromethyl)cyclopropyl]-3-(3,4-dihydroisoquinolin-1-yl)-2-oxopropanoate Traditional Name: 3-[1-(chloromethyl)cyclopropyl]-3-(3,4-dihydroisoquinolin-1-yl)-2-keto-propionic acid methyl ester Formula: C17H18ClNO3 MolecularWeight: 319.78272

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=O)C(C1=NCCC2=CC=CC=C21)C3(CC3)CCl

Isomeric SMILES

COC(=O)C(=O)C(C1=NCCC2=CC=CC=C21)C3(CC3)CCl

InChI

InChI=1S/C17H18ClNO3/c1-22-16(21)15(20)13(17(10-18)7-8-17)14-12-5-3-2-4-11(12)6-9-19-14/h2-5,13H,6-10H2,1H3