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2-[3-(4-phenylpiperazin-1-yl)propylamino]quinoline-4-carboxylic acid

2-[3-(4-phenylpiperazin-1-yl)propylamino]quinoline-4-carboxylic acid

Systemtic Name:2-[3-(4-phenylpiperazin-1-yl)propylamino]quinoline-4-carboxylic acid
Openeye Name:2-[3-(4-phenylpiperazin-1-yl)propylamino]quinoline-4-carboxylic acid
CAS Name:2-[3-(4-phenyl-1-piperazinyl)propylamino]-4-quinolinecarboxylic acid
IUPAC Name:2-[3-(4-phenylpiperazin-1-yl)propylamino]quinoline-4-carboxylic acid
Traditional Name:2-[3-(4-phenylpiperazino)propylamino]cinchoninic acid
Formula: C23H26N4O2
MolecularWeight: 390.47814
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC2=NC3=CC=CC=C3C(=C2)C(=O)O)C4=CC=CC=C4


Isomeric SMILES

C1CN(CCN1CCCNC2=NC3=CC=CC=C3C(=C2)C(=O)O)C4=CC=CC=C4


InChI

InChI=1S/C23H26N4O2/c28-23(29)20-17-22(25-21-10-5-4-9-19(20)21)24-11-6-12-26-13-15-27(16-14-26)18-7-2-1-3-8-18/h1-5,7-10,17H,6,11-16H2,(H,24,25)(H,28,29)


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