1-(3-azanylpropyl)-4-oxidanidyl-3-phenyl-quinoxalin-4-ium-2-one

Systemtic Name: 1-(3-azanylpropyl)-4-oxidanidyl-3-phenyl-quinoxalin-4-ium-2-one Openeye Name: 1-(3-aminopropyl)-4-oxido-3-phenyl-quinoxalin-4-ium-2-one CAS Name: 1-(3-aminopropyl)-4-oxido-3-phenyl-2-quinoxalin-4-iumone IUPAC Name: 1-(3-aminopropyl)-4-oxido-3-phenylquinoxalin-4-ium-2-one Traditional Name: 1-(3-aminopropyl)-4-oxido-3-phenyl-quinoxalin-4-ium-2-one Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=[N+](C3=CC=CC=C3N(C2=O)CCCN)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=[N+](C3=CC=CC=C3N(C2=O)CCCN)[O-]

InChI

InChI=1S/C17H17N3O2/c18-11-6-12-19-14-9-4-5-10-15(14)20(22)16(17(19)21)13-7-2-1-3-8-13/h1-5,7-10H,6,11-12,18H2