[1-naphthalen-1-yl-2-[[4-[(1-naphthalen-2-ylcarbonylpiperidin-4-yl)carbonylamino]naphthalen-2-yl]amino]-2-oxidanylidene-ethyl]phosphonic acid

Systemtic Name: [1-naphthalen-1-yl-2-[[4-[(1-naphthalen-2-ylcarbonylpiperidin-4-yl)carbonylamino]naphthalen-2-yl]amino]-2-oxidanylidene-ethyl]phosphonic acid Openeye Name: [2-[[4-[[1-(naphthalene-2-carbonyl)piperidine-4-carbonyl]amino]-2-naphthyl]amino]-1-(1-naphthyl)-2-oxo-ethyl]phosphonic acid CAS Name: [1-(1-naphthalenyl)-2-[[4-[[[1-[2-naphthalenyl(oxo)methyl]-4-piperidinyl]-oxomethyl]amino]-2-naphthalenyl]amino]-2-oxoethyl]phosphonic acid IUPAC Name: [2-[[4-[[1-(naphthalene-2-carbonyl)piperidine-4-carbonyl]amino]naphthalen-2-yl]amino]-1-naphthalen-1-yl-2-oxoethyl]phosphonic acid Traditional Name: [2-keto-2-[[4-[[1-(2-naphthoyl)isonipecotoyl]amino]-2-naphthyl]amino]-1-(1-naphthyl)ethyl]phosphonic acid Formula: C39H34N3O6P MolecularWeight: 671.677521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC(=CC3=CC=CC=C32)NC(=O)C(C4=CC=CC5=CC=CC=C54)P(=O)(O)O)C(=O)C6=CC7=CC=CC=C7C=C6

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC(=CC3=CC=CC=C32)NC(=O)C(C4=CC=CC5=CC=CC=C54)P(=O)(O)O)C(=O)C6=CC7=CC=CC=C7C=C6

InChI

InChI=1S/C39H34N3O6P/c43-37(27-18-20-42(21-19-27)39(45)30-17-16-25-8-1-2-10-28(25)22-30)41-35-24-31(23-29-11-4-6-14-33(29)35)40-38(44)36(49(46,47)48)34-15-7-12-26-9-3-5-13-32(26)34/h1-17,22-24,27,36H,18-21H2,(H,40,44)(H,41,43)(H2,46,47,48)