7-[diethoxyphosphoryl-[4-(1-ethanimidoylpiperidin-4-yl)oxyphenyl]methoxy]naphthalene-2-carboximidamide dihydrochloride

Systemtic Name: 7-[diethoxyphosphoryl-[4-(1-ethanimidoylpiperidin-4-yl)oxyphenyl]methoxy]naphthalene-2-carboximidamide dihydrochloride Openeye Name: 7-[diethoxyphosphoryl-[4-[(1-ethanimidoyl-4-piperidyl)oxy]phenyl]methoxy]naphthalene-2-carboxamidine dihydrochloride CAS Name: 7-[diethoxyphosphoryl-[4-[[1-(1-iminoethyl)-4-piperidinyl]oxy]phenyl]methoxy]-2-naphthalenecarboximidamide dihydrochloride IUPAC Name: 7-[diethoxyphosphoryl-[4-(1-ethanimidoylpiperidin-4-yl)oxyphenyl]methoxy]naphthalene-2-carboximidamide dihydrochloride Traditional Name: 7-[[4-[(1-acetimidoyl-4-piperidyl)oxy]phenyl]-diethoxyphosphoryl-methoxy]-2-naphthamidine dihydrochloride Formula: C29H39Cl2N4O5P MolecularWeight: 625.523521

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=CC=C(C=C1)OC2CCN(CC2)C(=N)C)OC3=CC4=C(C=CC(=C4)C(=N)N)C=C3)OCC.Cl.Cl

Isomeric SMILES

CCOP(=O)(C(C1=CC=C(C=C1)OC2CCN(CC2)C(=N)C)OC3=CC4=C(C=CC(=C4)C(=N)N)C=C3)OCC.Cl.Cl

InChI

InChI=1S/C29H37N4O5P.2ClH/c1-4-35-39(34,36-5-2)29(38-27-13-8-21-6-7-23(28(31)32)18-24(21)19-27)22-9-11-25(12-10-22)37-26-14-16-33(17-15-26)20(3)30;;/h6-13,18-19,26,29-30H,4-5,14-17H2,1-3H3,(H3,31,32);2*1H