1-[4-(2-methoxyphenyl)piperazin-1-yl]isoquinoline-4-carboxylic acid

Systemtic Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]isoquinoline-4-carboxylic acid Openeye Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]isoquinoline-4-carboxylic acid CAS Name: 1-[4-(2-methoxyphenyl)-1-piperazinyl]-4-isoquinolinecarboxylic acid IUPAC Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]isoquinoline-4-carboxylic acid Traditional Name: 1-[4-(2-methoxyphenyl)piperazino]isoquinoline-4-carboxylic acid Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=NC=C(C4=CC=CC=C43)C(=O)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=NC=C(C4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C21H21N3O3/c1-27-19-9-5-4-8-18(19)23-10-12-24(13-11-23)20-16-7-3-2-6-15(16)17(14-22-20)21(25)26/h2-9,14H,10-13H2,1H3,(H,25,26)