2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-methyl-1H-indol-3-yl)ethanoic acid

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-methyl-1H-indol-3-yl)ethanoic acid Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-methyl-1H-indol-3-yl)acetic acid CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-methyl-1H-indol-3-yl)acetic acid IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-methyl-1H-indol-3-yl)acetic acid Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-methyl-1H-indol-3-yl)acetic acid Formula: C20H20N2O2 MolecularWeight: 320.385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C20H20N2O2/c1-13-6-7-18-16(10-13)17(11-21-18)19(20(23)24)22-9-8-14-4-2-3-5-15(14)12-22/h2-7,10-11,19,21H,8-9,12H2,1H3,(H,23,24)