4-(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)-N-phenyl-piperazine-1-carboxamide CAS Name: 4-(3-cyano-6-ethoxy-2-quinolin-1-iumyl)-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-(3-cyano-6-ethoxyquinolin-1-ium-2-yl)-N-phenylpiperazine-1-carboxamide Traditional Name: 4-(3-cyano-6-ethoxy-quinolin-1-ium-2-yl)-N-phenyl-piperazine-1-carboxamide Formula: C23H24N5O2+ MolecularWeight: 402.46896

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)[NH+]=C(C(=C2)C#N)N3CCN(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)[NH+]=C(C(=C2)C#N)N3CCN(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H23N5O2/c1-2-30-20-8-9-21-17(15-20)14-18(16-24)22(26-21)27-10-12-28(13-11-27)23(29)25-19-6-4-3-5-7-19/h3-9,14-15H,2,10-13H2,1H3,(H,25,29)/p+1