7-methyl-3-(2-methylpropylamino)-1-pyrrolidin-1-yl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile

Systemtic Name: 7-methyl-3-(2-methylpropylamino)-1-pyrrolidin-1-yl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Openeye Name: 3-(isobutylamino)-7-methyl-1-pyrrolidin-1-yl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile CAS Name: 7-methyl-3-(2-methylpropylamino)-1-(1-pyrrolidinyl)-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile IUPAC Name: 7-methyl-3-(2-methylpropylamino)-1-pyrrolidin-1-yl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Traditional Name: 3-(isobutylamino)-7-methyl-1-pyrrolidino-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Formula: C18H29N5+2 MolecularWeight: 315.45636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=[NH+]C(=C2C[NH+](CCC2=C1C#N)C)N3CCCC3

Isomeric SMILES

CC(C)CNC1=[NH+]C(=C2C[NH+](CCC2=C1C#N)C)N3CCCC3

InChI

InChI=1S/C18H27N5/c1-13(2)11-20-17-15(10-19)14-6-9-22(3)12-16(14)18(21-17)23-7-4-5-8-23/h13H,4-9,11-12H2,1-3H3,(H,20,21)/p+2