ethyl 2-[(1S)-1-(2-aminophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanoate

Systemtic Name: ethyl 2-[(1S)-1-(2-aminophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanoate Openeye Name: ethyl 2-[(1S)-1-(2-aminophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]acetate CAS Name: 2-[(1S)-1-(2-aminophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(1S)-1-(2-aminophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]acetate Traditional Name: 2-[(1S)-1-(2-aminophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]acetic acid ethyl ester Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCC2=CC(=C(C=C2C1C3=CC=CC=C3N)OC)OC

Isomeric SMILES

CCOC(=O)CN1CCC2=CC(=C(C=C2[C@H]1C3=CC=CC=C3N)OC)OC

InChI

InChI=1S/C21H26N2O4/c1-4-27-20(24)13-23-10-9-14-11-18(25-2)19(26-3)12-16(14)21(23)15-7-5-6-8-17(15)22/h5-8,11-12,21H,4,9-10,13,22H2,1-3H3/t21-/m1/s1