2-(1-phenylpropan-2-yloxycarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: 2-(1-phenylpropan-2-yloxycarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-(1-methyl-2-phenyl-ethoxy)carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 2-[oxo(1-phenylpropan-2-yloxy)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-(1-phenylpropan-2-yloxycarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-(1-methyl-2-phenyl-ethoxy)carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)OC(=O)N2CC3=CC=CC=C3CC2C(=O)O

Isomeric SMILES

CC(CC1=CC=CC=C1)OC(=O)N2CC3=CC=CC=C3CC2C(=O)O

InChI

InChI=1S/C20H21NO4/c1-14(11-15-7-3-2-4-8-15)25-20(24)21-13-17-10-6-5-9-16(17)12-18(21)19(22)23/h2-10,14,18H,11-13H2,1H3,(H,22,23)