6-nitro-N-[2-(4-phenylpiperazin-1-yl)ethyl]quinolin-2-amine dihydrochloride

Systemtic Name: 6-nitro-N-[2-(4-phenylpiperazin-1-yl)ethyl]quinolin-2-amine dihydrochloride Openeye Name: 6-nitro-N-[2-(4-phenylpiperazin-1-yl)ethyl]quinolin-2-amine dihydrochloride CAS Name: 6-nitro-N-[2-(4-phenyl-1-piperazinyl)ethyl]-2-quinolinamine dihydrochloride IUPAC Name: 6-nitro-N-[2-(4-phenylpiperazin-1-yl)ethyl]quinolin-2-amine dihydrochloride Traditional Name: (6-nitro-2-quinolyl)-[2-(4-phenylpiperazino)ethyl]amine dihydrochloride Formula: C21H25Cl2N5O2 MolecularWeight: 450.3615

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC2=NC3=C(C=C2)C=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCNC2=NC3=C(C=C2)C=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C21H23N5O2.2ClH/c27-26(28)19-7-8-20-17(16-19)6-9-21(23-20)22-10-11-24-12-14-25(15-13-24)18-4-2-1-3-5-18;;/h1-9,16H,10-15H2,(H,22,23);2*1H