3-(butylamino)-7-ethyl-1-(furan-2-ylmethylamino)-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile

Systemtic Name: 3-(butylamino)-7-ethyl-1-(furan-2-ylmethylamino)-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Openeye Name: 3-(butylamino)-7-ethyl-1-(2-furylmethylamino)-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile CAS Name: 3-(butylamino)-7-ethyl-1-(2-furanylmethylamino)-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile IUPAC Name: 3-(butylamino)-7-ethyl-1-(furan-2-ylmethylamino)-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Traditional Name: 3-(butylamino)-7-ethyl-1-(2-furfurylamino)-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-4-carbonitrile Formula: C20H29N5O+2 MolecularWeight: 355.47716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=[NH+]C(=C2C[NH+](CCC2=C1C#N)CC)NCC3=CC=CO3

Isomeric SMILES

CCCCNC1=[NH+]C(=C2C[NH+](CCC2=C1C#N)CC)NCC3=CC=CO3

InChI

InChI=1S/C20H27N5O/c1-3-5-9-22-19-17(12-21)16-8-10-25(4-2)14-18(16)20(24-19)23-13-15-7-6-11-26-15/h6-7,11H,3-5,8-10,13-14H2,1-2H3,(H2,22,23,24)/p+2