(4-cyano-3,5-diethoxy-2-methyl-naphthalen-1-yl)phosphonic acid

Systemtic Name: (4-cyano-3,5-diethoxy-2-methyl-naphthalen-1-yl)phosphonic acid Openeye Name: (4-cyano-3,5-diethoxy-2-methyl-1-naphthyl)phosphonic acid CAS Name: (4-cyano-3,5-diethoxy-2-methyl-1-naphthalenyl)phosphonic acid IUPAC Name: (4-cyano-3,5-diethoxy-2-methylnaphthalen-1-yl)phosphonic acid Traditional Name: (4-cyano-3,5-diethoxy-2-methyl-1-naphthyl)phosphonic acid Formula: C16H18NO5P MolecularWeight: 335.291581

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C(C(=C(C(=C21)C#N)OCC)C)P(=O)(O)O

Isomeric SMILES

CCOC1=CC=CC2=C(C(=C(C(=C21)C#N)OCC)C)P(=O)(O)O

InChI

InChI=1S/C16H18NO5P/c1-4-21-13-8-6-7-11-14(13)12(9-17)15(22-5-2)10(3)16(11)23(18,19)20/h6-8H,4-5H2,1-3H3,(H2,18,19,20)