[2-[(6-azanylpyridin-3-yl)methyl]-3-oxidanyl-3-oxidanylidene-propyl]-oxidanylidene-(1-oxidanyl-3-phenyl-propyl)phosphanium

Systemtic Name: [2-[(6-azanylpyridin-3-yl)methyl]-3-oxidanyl-3-oxidanylidene-propyl]-oxidanylidene-(1-oxidanyl-3-phenyl-propyl)phosphanium Openeye Name: [2-[(6-amino-3-pyridyl)methyl]-3-hydroxy-3-oxo-propyl]-(1-hydroxy-3-phenyl-propyl)-oxo-phosphonium CAS Name: [2-[(6-amino-3-pyridinyl)methyl]-3-hydroxy-3-oxopropyl]-(1-hydroxy-3-phenylpropyl)-oxophosphonium IUPAC Name: [2-[(6-aminopyridin-3-yl)methyl]-3-hydroxy-3-oxopropyl]-(1-hydroxy-3-phenylpropyl)-oxophosphanium Traditional Name: [2-[(6-amino-3-pyridyl)methyl]-3-hydroxy-3-keto-propyl]-(1-hydroxy-3-phenyl-propyl)-keto-phosphonium Formula: C18H22N2O4P+ MolecularWeight: 361.352041

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(O)[P+](=O)CC(CC2=CN=C(C=C2)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC(O)[P+](=O)CC(CC2=CN=C(C=C2)N)C(=O)O

InChI

InChI=1S/C18H21N2O4P/c19-16-8-6-14(11-20-16)10-15(18(22)23)12-25(24)17(21)9-7-13-4-2-1-3-5-13/h1-6,8,11,15,17,21H,7,9-10,12H2,(H2-,19,20,22,23)/p+1