1,8-bis(azanyl)-3-[butyl(ethyl)amino]-6-ethoxy-2,7-naphthyridin-7-ium-4-carbonitrile

Systemtic Name: 1,8-bis(azanyl)-3-[butyl(ethyl)amino]-6-ethoxy-2,7-naphthyridin-7-ium-4-carbonitrile Openeye Name: 1,8-diamino-3-[butyl(ethyl)amino]-6-ethoxy-2,7-naphthyridin-7-ium-4-carbonitrile CAS Name: 1,8-diamino-3-[butyl(ethyl)amino]-6-ethoxy-2,7-naphthyridin-7-ium-4-carbonitrile IUPAC Name: 1,8-diamino-3-[butyl(ethyl)amino]-6-ethoxy-2,7-naphthyridin-7-ium-4-carbonitrile Traditional Name: 1,8-diamino-3-[butyl(ethyl)amino]-6-ethoxy-2,7-naphthyridin-7-ium-4-carbonitrile Formula: C17H25N6O+ MolecularWeight: 329.42

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C1=C(C2=CC(=[NH+]C(=C2C(=N1)N)N)OCC)C#N

Isomeric SMILES

CCCCN(CC)C1=C(C2=CC(=[NH+]C(=C2C(=N1)N)N)OCC)C#N

InChI

InChI=1S/C17H24N6O/c1-4-7-8-23(5-2)17-12(10-18)11-9-13(24-6-3)21-15(19)14(11)16(20)22-17/h9H,4-8H2,1-3H3,(H2,19,21)(H2,20,22)/p+1