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2-[3-[[4,6-bis(chloranyl)-1H-indol-2-yl]methylamino]propylamino]quinoline-4-carboxylic acid

2-[3-[[4,6-bis(chloranyl)-1H-indol-2-yl]methylamino]propylamino]quinoline-4-carboxylic acid

Systemtic Name:2-[3-[[4,6-bis(chloranyl)-1H-indol-2-yl]methylamino]propylamino]quinoline-4-carboxylic acid
Openeye Name:2-[3-[(4,6-dichloro-1H-indol-2-yl)methylamino]propylamino]quinoline-4-carboxylic acid
CAS Name:2-[3-[(4,6-dichloro-1H-indol-2-yl)methylamino]propylamino]-4-quinolinecarboxylic acid
IUPAC Name:2-[3-[(4,6-dichloro-1H-indol-2-yl)methylamino]propylamino]quinoline-4-carboxylic acid
Traditional Name:2-[3-[(4,6-dichloro-1H-indol-2-yl)methylamino]propylamino]cinchoninic acid
Formula: C22H20Cl2N4O2
MolecularWeight: 443.3258
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)NCCCNCC3=CC4=C(C=C(C=C4N3)Cl)Cl)C(=O)O


Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)NCCCNCC3=CC4=C(C=C(C=C4N3)Cl)Cl)C(=O)O


InChI

InChI=1S/C22H20Cl2N4O2/c23-13-8-18(24)17-10-14(27-20(17)9-13)12-25-6-3-7-26-21-11-16(22(29)30)15-4-1-2-5-19(15)28-21/h1-2,4-5,8-11,25,27H,3,6-7,12H2,(H,26,28)(H,29,30)


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