sodium [[(4-ethoxycarbonylphenyl)amino]-phenyl-methyl]phosphonic acid

Systemtic Name: sodium [[(4-ethoxycarbonylphenyl)amino]-phenyl-methyl]phosphonic acid Openeye Name: sodium [(4-ethoxycarbonylanilino)-phenyl-methyl]phosphonic acid CAS Name: sodium [(4-ethoxycarbonylanilino)-phenylmethyl]phosphonic acid IUPAC Name: sodium [(4-ethoxycarbonylanilino)-phenylmethyl]phosphonic acid Traditional Name: sodium [(4-carbethoxyanilino)-phenyl-methyl]phosphonic acid Formula: C16H18NNaO5P+ MolecularWeight: 358.281351

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(C2=CC=CC=C2)P(=O)(O)O.[Na+]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(C2=CC=CC=C2)P(=O)(O)O.[Na+]

InChI

InChI=1S/C16H18NO5P.Na/c1-2-22-16(18)13-8-10-14(11-9-13)17-15(23(19,20)21)12-6-4-3-5-7-12;/h3-11,15,17H,2H2,1H3,(H2,19,20,21);/q;+1