N-(7-chloranyl-4-oxidanylidene-1H-quinolin-3-yl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide

Systemtic Name: N-(7-chloranyl-4-oxidanylidene-1H-quinolin-3-yl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide Openeye Name: N-(7-chloro-4-oxo-1H-quinolin-3-yl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide CAS Name: N-(7-chloro-4-oxo-1H-quinolin-3-yl)-4-(2-pyridin-1-iumyl)-1-piperazinecarboxamide IUPAC Name: N-(7-chloro-4-oxo-1H-quinolin-3-yl)-4-pyridin-1-ium-2-ylpiperazine-1-carboxamide Traditional Name: N-(7-chloro-4-keto-1H-quinolin-3-yl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide Formula: C19H19ClN5O2+ MolecularWeight: 384.83946

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)NC3=CNC4=C(C3=O)C=CC(=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)NC3=CNC4=C(C3=O)C=CC(=C4)Cl

InChI

InChI=1S/C19H18ClN5O2/c20-13-4-5-14-15(11-13)22-12-16(18(14)26)23-19(27)25-9-7-24(8-10-25)17-3-1-2-6-21-17/h1-6,11-12H,7-10H2,(H,22,26)(H,23,27)/p+1