methyl 3-[(3S)-3-(2-methoxy-2-oxidanylidene-ethyl)-3,4-dihydro-1H-isoquinolin-2-yl]propanoate

Systemtic Name: methyl 3-[(3S)-3-(2-methoxy-2-oxidanylidene-ethyl)-3,4-dihydro-1H-isoquinolin-2-yl]propanoate Openeye Name: methyl 3-[(3S)-3-(2-methoxy-2-oxo-ethyl)-3,4-dihydro-1H-isoquinolin-2-yl]propanoate CAS Name: 3-[(3S)-3-(2-methoxy-2-oxoethyl)-3,4-dihydro-1H-isoquinolin-2-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[(3S)-3-(2-methoxy-2-oxoethyl)-3,4-dihydro-1H-isoquinolin-2-yl]propanoate Traditional Name: 3-[(3S)-3-(2-keto-2-methoxy-ethyl)-3,4-dihydro-1H-isoquinolin-2-yl]propionic acid methyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1CC2=CC=CC=C2CC1CC(=O)OC

Isomeric SMILES

COC(=O)CCN1CC2=CC=CC=C2C[C@H]1CC(=O)OC

InChI

InChI=1S/C16H21NO4/c1-20-15(18)7-8-17-11-13-6-4-3-5-12(13)9-14(17)10-16(19)21-2/h3-6,14H,7-11H2,1-2H3/t14-/m0/s1