methyl (3R)-2-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl (3R)-2-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (3R)-2-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxo-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-2-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-[2-keto-2-[2-(2-methoxyphenyl)ethylamino]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCNC(=O)CN2CC3=CC=CC=C3CC2C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1CCNC(=O)CN2CC3=CC=CC=C3C[C@@H]2C(=O)OC

InChI

InChI=1S/C22H26N2O4/c1-27-20-10-6-5-7-16(20)11-12-23-21(25)15-24-14-18-9-4-3-8-17(18)13-19(24)22(26)28-2/h3-10,19H,11-15H2,1-2H3,(H,23,25)/t19-/m1/s1