7-methyl-3-(3-morpholin-4-ium-4-ylpropylamino)-1-[[(2S)-oxolan-2-yl]methylamino]-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile

Systemtic Name: 7-methyl-3-(3-morpholin-4-ium-4-ylpropylamino)-1-[[(2S)-oxolan-2-yl]methylamino]-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Openeye Name: 7-methyl-3-(3-morpholin-4-ium-4-ylpropylamino)-1-[[(2S)-tetrahydrofuran-2-yl]methylamino]-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile CAS Name: 7-methyl-3-[3-(4-morpholin-4-iumyl)propylamino]-1-[[(2S)-2-oxolanyl]methylamino]-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile IUPAC Name: 7-methyl-3-(3-morpholin-4-ium-4-ylpropylamino)-1-[[(2S)-oxolan-2-yl]methylamino]-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Traditional Name: 7-methyl-3-(3-morpholin-4-ium-4-ylpropylamino)-1-[[(2S)-tetrahydrofuran-2-yl]methylamino]-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Formula: C22H37N6O2+3 MolecularWeight: 417.56818

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=C(C(=[NH+]C(=C2C1)NCC3CCCO3)NCCC[NH+]4CCOCC4)C#N

Isomeric SMILES

C[NH+]1CCC2=C(C(=[NH+]C(=C2C1)NC[C@@H]3CCCO3)NCCC[NH+]4CCOCC4)C#N

InChI

InChI=1S/C22H34N6O2/c1-27-8-5-18-19(14-23)21(24-6-3-7-28-9-12-29-13-10-28)26-22(20(18)16-27)25-15-17-4-2-11-30-17/h17H,2-13,15-16H2,1H3,(H2,24,25,26)/p+3/t17-/m0/s1