1-(butylamino)-7-methyl-3-(3-oxidanylpropylamino)-5,6,7,8-tetrahydro-2,7-naphthyridin-7-ium-4-carbonitrile

Systemtic Name: 1-(butylamino)-7-methyl-3-(3-oxidanylpropylamino)-5,6,7,8-tetrahydro-2,7-naphthyridin-7-ium-4-carbonitrile Openeye Name: 1-(butylamino)-3-(3-hydroxypropylamino)-7-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-7-ium-4-carbonitrile CAS Name: 1-(butylamino)-3-(3-hydroxypropylamino)-7-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-7-ium-4-carbonitrile IUPAC Name: 1-(butylamino)-3-(3-hydroxypropylamino)-7-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-7-ium-4-carbonitrile Traditional Name: 1-(butylamino)-3-(3-hydroxypropylamino)-7-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-7-ium-4-carbonitrile Formula: C17H28N5O+ MolecularWeight: 318.43712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C2C[NH+](CCC2=C(C(=N1)NCCCO)C#N)C

Isomeric SMILES

CCCCNC1=C2C[NH+](CCC2=C(C(=N1)NCCCO)C#N)C

InChI

InChI=1S/C17H27N5O/c1-3-4-7-19-17-15-12-22(2)9-6-13(15)14(11-18)16(21-17)20-8-5-10-23/h23H,3-10,12H2,1-2H3,(H2,19,20,21)/p+1