5-[[2-(hydroxymethyl)pyridin-4-yl]methyl-methyl-amino]-8-nitro-naphthalene-1-carbonitrile

Systemtic Name: 5-[[2-(hydroxymethyl)pyridin-4-yl]methyl-methyl-amino]-8-nitro-naphthalene-1-carbonitrile Openeye Name: 5-[[2-(hydroxymethyl)-4-pyridyl]methyl-methyl-amino]-8-nitro-naphthalene-1-carbonitrile CAS Name: 5-[[2-(hydroxymethyl)-4-pyridinyl]methyl-methylamino]-8-nitro-1-naphthalenecarbonitrile IUPAC Name: 5-[[2-(hydroxymethyl)pyridin-4-yl]methyl-methylamino]-8-nitronaphthalene-1-carbonitrile Traditional Name: 5-[methyl-[(2-methylol-4-pyridyl)methyl]amino]-8-nitro-naphthalene-1-carbonitrile Formula: C19H16N4O3 MolecularWeight: 348.35534

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=NC=C1)CO)C2=CC=C(C3=C(C=CC=C23)C#N)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC(=NC=C1)CO)C2=CC=C(C3=C(C=CC=C23)C#N)[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O3/c1-22(11-13-7-8-21-15(9-13)12-24)17-5-6-18(23(25)26)19-14(10-20)3-2-4-16(17)19/h2-9,24H,11-12H2,1H3