[[[4-[(2-butylbenzimidazol-1-yl)methyl]phenyl]amino]-phenyl-methyl]-ethoxy-phosphinic acid

Systemtic Name: [[[4-[(2-butylbenzimidazol-1-yl)methyl]phenyl]amino]-phenyl-methyl]-ethoxy-phosphinic acid Openeye Name: [[4-[(2-butylbenzimidazol-1-yl)methyl]anilino]-phenyl-methyl]-ethoxy-phosphinic acid CAS Name: [[4-[(2-butyl-1-benzimidazolyl)methyl]anilino]-phenylmethyl]-ethoxyphosphinic acid IUPAC Name: [[4-[(2-butylbenzimidazol-1-yl)methyl]anilino]-phenylmethyl]-ethoxyphosphinic acid Traditional Name: [[4-[(2-butylbenzimidazol-1-yl)methyl]anilino]-phenyl-methyl]-ethoxy-phosphinic acid Formula: C27H32N3O3P MolecularWeight: 477.535041

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)NC(C4=CC=CC=C4)P(=O)(O)OCC

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)NC(C4=CC=CC=C4)P(=O)(O)OCC

InChI

InChI=1S/C27H32N3O3P/c1-3-5-15-26-29-24-13-9-10-14-25(24)30(26)20-21-16-18-23(19-17-21)28-27(34(31,32)33-4-2)22-11-7-6-8-12-22/h6-14,16-19,27-28H,3-5,15,20H2,1-2H3,(H,31,32)