3-(2-diethylaminoethylimino)-7-methoxy-1-oxidanidyl-4-oxidanyl-quinoxalin-1-ium-2-carbonitrile

Systemtic Name: 3-(2-diethylaminoethylimino)-7-methoxy-1-oxidanidyl-4-oxidanyl-quinoxalin-1-ium-2-carbonitrile Openeye Name: 3-(2-diethylaminoethylimino)-4-hydroxy-7-methoxy-1-oxido-quinoxalin-1-ium-2-carbonitrile CAS Name: 3-(2-diethylaminoethylimino)-4-hydroxy-7-methoxy-1-oxido-2-quinoxalin-1-iumcarbonitrile IUPAC Name: 3-(2-diethylaminoethylimino)-4-hydroxy-7-methoxy-1-oxidoquinoxalin-1-ium-2-carbonitrile Traditional Name: 3-(2-diethylaminoethylimino)-4-hydroxy-7-methoxy-1-oxido-quinoxalin-1-ium-2-carbonitrile Formula: C16H21N5O3 MolecularWeight: 331.36964

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN=C1C(=[N+](C2=C(N1O)C=CC(=C2)OC)[O-])C#N

Isomeric SMILES

CCN(CC)CCN=C1C(=[N+](C2=C(N1O)C=CC(=C2)OC)[O-])C#N

InChI

InChI=1S/C16H21N5O3/c1-4-19(5-2)9-8-18-16-15(11-17)20(22)14-10-12(24-3)6-7-13(14)21(16)23/h6-7,10,23H,4-5,8-9H2,1-3H3