1,8-bis(azanyl)-3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6-methoxy-2,7-naphthyridin-7-ium-4-carbonitrile

Systemtic Name: 1,8-bis(azanyl)-3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6-methoxy-2,7-naphthyridin-7-ium-4-carbonitrile Openeye Name: 1,8-diamino-3-[4-(furan-2-carbonyl)piperazin-1-yl]-6-methoxy-2,7-naphthyridin-7-ium-4-carbonitrile CAS Name: 1,8-diamino-3-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-6-methoxy-2,7-naphthyridin-7-ium-4-carbonitrile IUPAC Name: 1,8-diamino-3-[4-(furan-2-carbonyl)piperazin-1-yl]-6-methoxy-2,7-naphthyridin-7-ium-4-carbonitrile Traditional Name: 1,8-diamino-3-[4-(2-furoyl)piperazino]-6-methoxy-2,7-naphthyridin-7-ium-4-carbonitrile Formula: C19H20N7O3+ MolecularWeight: 394.4072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=[NH+]C(=C2C(=C1)C(=C(N=C2N)N3CCN(CC3)C(=O)C4=CC=CO4)C#N)N

Isomeric SMILES

COC1=[NH+]C(=C2C(=C1)C(=C(N=C2N)N3CCN(CC3)C(=O)C4=CC=CO4)C#N)N

InChI

InChI=1S/C19H19N7O3/c1-28-14-9-11-12(10-20)18(24-17(22)15(11)16(21)23-14)25-4-6-26(7-5-25)19(27)13-3-2-8-29-13/h2-3,8-9H,4-7H2,1H3,(H2,21,23)(H2,22,24)/p+1