1,8-bis(azanyl)-6-methoxy-3-pyrrolidin-1-yl-2,7-naphthyridine-4-carbonitrile; ethanoic acid

Systemtic Name: 1,8-bis(azanyl)-6-methoxy-3-pyrrolidin-1-yl-2,7-naphthyridine-4-carbonitrile; ethanoic acid Openeye Name: acetic acid; 1,8-diamino-6-methoxy-3-pyrrolidin-1-yl-2,7-naphthyridine-4-carbonitrile CAS Name: acetic acid; 1,8-diamino-6-methoxy-3-(1-pyrrolidinyl)-2,7-naphthyridine-4-carbonitrile IUPAC Name: acetic acid; 1,8-diamino-6-methoxy-3-pyrrolidin-1-yl-2,7-naphthyridine-4-carbonitrile Traditional Name: acetic acid; 1,8-diamino-6-methoxy-3-pyrrolidino-2,7-naphthyridine-4-carbonitrile Formula: C16H20N6O3 MolecularWeight: 344.3684

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.COC1=NC(=C2C(=C1)C(=C(N=C2N)N3CCCC3)C#N)N

Isomeric SMILES

CC(=O)O.COC1=NC(=C2C(=C1)C(=C(N=C2N)N3CCCC3)C#N)N

InChI

InChI=1S/C14H16N6O.C2H4O2/c1-21-10-6-8-9(7-15)14(20-4-2-3-5-20)19-13(17)11(8)12(16)18-10;1-2(3)4/h6H,2-5H2,1H3,(H2,16,18)(H2,17,19);1H3,(H,3,4)