1,8-bis(azanyl)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-6-methoxy-2,7-naphthyridin-7-ium-4-carbonitrile

Systemtic Name: 1,8-bis(azanyl)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-6-methoxy-2,7-naphthyridin-7-ium-4-carbonitrile Openeye Name: 1,8-diamino-3-(3,4-dihydro-1H-isoquinolin-2-yl)-6-methoxy-2,7-naphthyridin-7-ium-4-carbonitrile CAS Name: 1,8-diamino-3-(3,4-dihydro-1H-isoquinolin-2-yl)-6-methoxy-2,7-naphthyridin-7-ium-4-carbonitrile IUPAC Name: 1,8-diamino-3-(3,4-dihydro-1H-isoquinolin-2-yl)-6-methoxy-2,7-naphthyridin-7-ium-4-carbonitrile Traditional Name: 1,8-diamino-3-(3,4-dihydro-1H-isoquinolin-2-yl)-6-methoxy-2,7-naphthyridin-7-ium-4-carbonitrile Formula: C19H19N6O+ MolecularWeight: 347.39376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=[NH+]C(=C2C(=C1)C(=C(N=C2N)N3CCC4=CC=CC=C4C3)C#N)N

Isomeric SMILES

COC1=[NH+]C(=C2C(=C1)C(=C(N=C2N)N3CCC4=CC=CC=C4C3)C#N)N

InChI

InChI=1S/C19H18N6O/c1-26-15-8-13-14(9-20)19(24-18(22)16(13)17(21)23-15)25-7-6-11-4-2-3-5-12(11)10-25/h2-5,8H,6-7,10H2,1H3,(H2,21,23)(H2,22,24)/p+1