2-methyl-4-(4-phenylpiperazin-1-yl)quinoline-8-carboxylic acid

Systemtic Name: 2-methyl-4-(4-phenylpiperazin-1-yl)quinoline-8-carboxylic acid Openeye Name: 2-methyl-4-(4-phenylpiperazin-1-yl)quinoline-8-carboxylic acid CAS Name: 2-methyl-4-(4-phenyl-1-piperazinyl)-8-quinolinecarboxylic acid IUPAC Name: 2-methyl-4-(4-phenylpiperazin-1-yl)quinoline-8-carboxylic acid Traditional Name: 2-methyl-4-(4-phenylpiperazino)quinoline-8-carboxylic acid Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2C(=O)O)C(=C1)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(C=CC=C2C(=O)O)C(=C1)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O2/c1-15-14-19(17-8-5-9-18(21(25)26)20(17)22-15)24-12-10-23(11-13-24)16-6-3-2-4-7-16/h2-9,14H,10-13H2,1H3,(H,25,26)