2-(2-methylphenyl)carbonyl-7-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: 2-(2-methylphenyl)carbonyl-7-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-(2-methylbenzoyl)-7-[2-(2-phenyloxazol-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 2-[(2-methylphenyl)-oxomethyl]-7-[2-(2-phenyl-4-oxazolyl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-(2-methylbenzoyl)-7-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-o-toluoyl-7-[2-(2-phenyloxazol-4-yl)ethoxy]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C29H26N2O5 MolecularWeight: 482.52714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CC3=C(CC2C(=O)O)C=CC(=C3)OCCC4=COC(=N4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CC3=C(CC2C(=O)O)C=CC(=C3)OCCC4=COC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C29H26N2O5/c1-19-7-5-6-10-25(19)28(32)31-17-22-15-24(12-11-21(22)16-26(31)29(33)34)35-14-13-23-18-36-27(30-23)20-8-3-2-4-9-20/h2-12,15,18,26H,13-14,16-17H2,1H3,(H,33,34)