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

Systemtic Name: 3-(3-ethoxypropylamino)-7-methyl-1-[[(2S)-oxolan-2-yl]methylamino]-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Openeye Name: 3-(3-ethoxypropylamino)-7-methyl-1-[[(2S)-tetrahydrofuran-2-yl]methylamino]-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile CAS Name: 3-(3-ethoxypropylamino)-7-methyl-1-[[(2S)-2-oxolanyl]methylamino]-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile IUPAC Name: 3-(3-ethoxypropylamino)-7-methyl-1-[[(2S)-oxolan-2-yl]methylamino]-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Traditional Name: 3-(3-ethoxypropylamino)-7-methyl-1-[[(2S)-tetrahydrofuran-2-yl]methylamino]-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Formula: C20H33N5O2+2 MolecularWeight: 375.50832

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC1=[NH+]C(=C2C[NH+](CCC2=C1C#N)C)NCC3CCCO3

Isomeric SMILES

CCOCCCNC1=[NH+]C(=C2C[NH+](CCC2=C1C#N)C)NC[C@@H]3CCCO3

InChI

InChI=1S/C20H31N5O2/c1-3-26-10-5-8-22-19-17(12-21)16-7-9-25(2)14-18(16)20(24-19)23-13-15-6-4-11-27-15/h15H,3-11,13-14H2,1-2H3,(H2,22,23,24)/p+2/t15-/m0/s1