5-[(4-methylpiperazin-1-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid

Systemtic Name: 5-[(4-methylpiperazin-1-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Openeye Name: 5-[(4-methylpiperazin-1-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid CAS Name: 5-[(4-methyl-1-piperazinyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid IUPAC Name: 5-[(4-methylpiperazin-1-yl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Traditional Name: 5-[(4-methylpiperazino)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Formula: C16H23N3O2 MolecularWeight: 289.37272

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC=CC3=C2CCN(C3)C(=O)O

Isomeric SMILES

CN1CCN(CC1)CC2=CC=CC3=C2CCN(C3)C(=O)O

InChI

InChI=1S/C16H23N3O2/c1-17-7-9-18(10-8-17)11-13-3-2-4-14-12-19(16(20)21)6-5-15(13)14/h2-4H,5-12H2,1H3,(H,20,21)