[2-[4-azanyl-1-[(3-hydroxyphenyl)methyl]benzimidazol-2-yl]furan-3-yl]phosphonic acid

Systemtic Name: [2-[4-azanyl-1-[(3-hydroxyphenyl)methyl]benzimidazol-2-yl]furan-3-yl]phosphonic acid Openeye Name: [2-[4-amino-1-[(3-hydroxyphenyl)methyl]benzimidazol-2-yl]-3-furyl]phosphonic acid CAS Name: [2-[4-amino-1-[(3-hydroxyphenyl)methyl]-2-benzimidazolyl]-3-furanyl]phosphonic acid IUPAC Name: [2-[4-amino-1-[(3-hydroxyphenyl)methyl]benzimidazol-2-yl]furan-3-yl]phosphonic acid Traditional Name: [2-[4-amino-1-(3-hydroxybenzyl)benzimidazol-2-yl]-3-furyl]phosphonic acid Formula: C18H16N3O5P MolecularWeight: 385.310501

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)CN2C3=C(C(=CC=C3)N)N=C2C4=C(C=CO4)P(=O)(O)O

Isomeric SMILES

C1=CC(=CC(=C1)O)CN2C3=C(C(=CC=C3)N)N=C2C4=C(C=CO4)P(=O)(O)O

InChI

InChI=1S/C18H16N3O5P/c19-13-5-2-6-14-16(13)20-18(17-15(7-8-26-17)27(23,24)25)21(14)10-11-3-1-4-12(22)9-11/h1-9,22H,10,19H2,(H2,23,24,25)