methyl 2-[(1S)-2-(4-ethylphenyl)carbonyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate

Systemtic Name: methyl 2-[(1S)-2-(4-ethylphenyl)carbonyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate Openeye Name: methyl 2-[(1S)-2-(4-ethylbenzoyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetate CAS Name: 2-[(1S)-2-[(4-ethylphenyl)-oxomethyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(1S)-2-(4-ethylbenzoyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetate Traditional Name: 2-[(1S)-2-(4-ethylbenzoyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCC3=CC(=C(C=C3C2CC(=O)OC)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCC3=CC(=C(C=C3[C@@H]2CC(=O)OC)OC)OC

InChI

InChI=1S/C23H27NO5/c1-5-15-6-8-16(9-7-15)23(26)24-11-10-17-12-20(27-2)21(28-3)13-18(17)19(24)14-22(25)29-4/h6-9,12-13,19H,5,10-11,14H2,1-4H3/t19-/m0/s1