[[1-[(5-carboxy-1H-pyrrol-3-yl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-oxidanylidene-(3-oxidanylpropyl)phosphanium

Systemtic Name: [[1-[(5-carboxy-1H-pyrrol-3-yl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-oxidanylidene-(3-oxidanylpropyl)phosphanium Openeye Name: [[1-benzyl-2-[(5-carboxy-1H-pyrrol-3-yl)amino]-2-oxo-ethyl]amino]-(3-hydroxypropyl)-oxo-phosphonium CAS Name: [[1-[(5-carboxy-1H-pyrrol-3-yl)amino]-1-oxo-3-phenylpropan-2-yl]amino]-(3-hydroxypropyl)-oxophosphonium IUPAC Name: [[1-[(5-carboxy-1H-pyrrol-3-yl)amino]-1-oxo-3-phenylpropan-2-yl]amino]-(3-hydroxypropyl)-oxophosphanium Traditional Name: [[1-benzyl-2-[(5-carboxy-1H-pyrrol-3-yl)amino]-2-keto-ethyl]amino]-(3-hydroxypropyl)-keto-phosphonium Formula: C17H21N3O5P+ MolecularWeight: 378.339501

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=CNC(=C2)C(=O)O)N[P+](=O)CCCO

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC2=CNC(=C2)C(=O)O)N[P+](=O)CCCO

InChI

InChI=1S/C17H20N3O5P/c21-7-4-8-26(25)20-14(9-12-5-2-1-3-6-12)16(22)19-13-10-15(17(23)24)18-11-13/h1-3,5-6,10-11,14,18,21H,4,7-9H2,(H2-,19,20,22,23,24,25)/p+1