6-chloranyl-3-(3-morpholin-4-ylpropylimino)-1-oxidanidyl-4-oxidanyl-quinoxalin-1-ium-2-carbonitrile

Systemtic Name: 6-chloranyl-3-(3-morpholin-4-ylpropylimino)-1-oxidanidyl-4-oxidanyl-quinoxalin-1-ium-2-carbonitrile Openeye Name: 6-chloro-4-hydroxy-3-(3-morpholinopropylimino)-1-oxido-quinoxalin-1-ium-2-carbonitrile CAS Name: 6-chloro-4-hydroxy-3-[3-(4-morpholinyl)propylimino]-1-oxido-2-quinoxalin-1-iumcarbonitrile IUPAC Name: 6-chloro-4-hydroxy-3-(3-morpholin-4-ylpropylimino)-1-oxidoquinoxalin-1-ium-2-carbonitrile Traditional Name: 6-chloro-4-hydroxy-3-(3-morpholinopropylimino)-1-oxido-quinoxalin-1-ium-2-carbonitrile Formula: C16H18ClN5O3 MolecularWeight: 363.79882

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN=C2C(=[N+](C3=C(N2O)C=C(C=C3)Cl)[O-])C#N

Isomeric SMILES

C1COCCN1CCCN=C2C(=[N+](C3=C(N2O)C=C(C=C3)Cl)[O-])C#N

InChI

InChI=1S/C16H18ClN5O3/c17-12-2-3-13-14(10-12)22(24)16(15(11-18)21(13)23)19-4-1-5-20-6-8-25-9-7-20/h2-3,10,24H,1,4-9H2