1-(4-methylpiperazin-1-yl)isoquinoline-3-carboxylic acid

Systemtic Name: 1-(4-methylpiperazin-1-yl)isoquinoline-3-carboxylic acid Openeye Name: 1-(4-methylpiperazin-1-yl)isoquinoline-3-carboxylic acid CAS Name: 1-(4-methyl-1-piperazinyl)-3-isoquinolinecarboxylic acid IUPAC Name: 1-(4-methylpiperazin-1-yl)isoquinoline-3-carboxylic acid Traditional Name: 1-(4-methylpiperazino)isoquinoline-3-carboxylic acid Formula: C15H17N3O2 MolecularWeight: 271.31438

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C15H17N3O2/c1-17-6-8-18(9-7-17)14-12-5-3-2-4-11(12)10-13(16-14)15(19)20/h2-5,10H,6-9H2,1H3,(H,19,20)