2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(7-methoxy-1H-indol-3-yl)ethanoic acid

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(7-methoxy-1H-indol-3-yl)ethanoic acid Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(7-methoxy-1H-indol-3-yl)acetic acid CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(7-methoxy-1H-indol-3-yl)acetic acid IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(7-methoxy-1H-indol-3-yl)acetic acid Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(7-methoxy-1H-indol-3-yl)acetic acid Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1NC=C2C(C(=O)O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=CC2=C1NC=C2C(C(=O)O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C20H20N2O3/c1-25-17-8-4-7-15-16(11-21-18(15)17)19(20(23)24)22-10-9-13-5-2-3-6-14(13)12-22/h2-8,11,19,21H,9-10,12H2,1H3,(H,23,24)