2-methyl-4-(4-phenylpiperazin-1-yl)quinoline-6-carboxylic acid

Systemtic Name: 2-methyl-4-(4-phenylpiperazin-1-yl)quinoline-6-carboxylic acid Openeye Name: 2-methyl-4-(4-phenylpiperazin-1-yl)quinoline-6-carboxylic acid CAS Name: 2-methyl-4-(4-phenyl-1-piperazinyl)-6-quinolinecarboxylic acid IUPAC Name: 2-methyl-4-(4-phenylpiperazin-1-yl)quinoline-6-carboxylic acid Traditional Name: 2-methyl-4-(4-phenylpiperazino)quinoline-6-carboxylic acid Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)O)C(=C1)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)O)C(=C1)N3CCN(CC3)C4=CC=CC=C4

InChI

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