[1-naphthalen-1-yl-2-[3-[(1-naphthalen-2-ylcarbonylpiperidin-4-yl)carbamoyl]naphthalen-2-yl]-2-oxidanylidene-ethyl]phosphonic acid

Systemtic Name: [1-naphthalen-1-yl-2-[3-[(1-naphthalen-2-ylcarbonylpiperidin-4-yl)carbamoyl]naphthalen-2-yl]-2-oxidanylidene-ethyl]phosphonic acid Openeye Name: [2-[3-[[1-(naphthalene-2-carbonyl)-4-piperidyl]carbamoyl]-2-naphthyl]-1-(1-naphthyl)-2-oxo-ethyl]phosphonic acid CAS Name: [1-(1-naphthalenyl)-2-[3-[[[1-[2-naphthalenyl(oxo)methyl]-4-piperidinyl]amino]-oxomethyl]-2-naphthalenyl]-2-oxoethyl]phosphonic acid IUPAC Name: [2-[3-[[1-(naphthalene-2-carbonyl)piperidin-4-yl]carbamoyl]naphthalen-2-yl]-1-naphthalen-1-yl-2-oxoethyl]phosphonic acid Traditional Name: [2-keto-2-[3-[[1-(2-naphthoyl)-4-piperidyl]carbamoyl]-2-naphthyl]-1-(1-naphthyl)ethyl]phosphonic acid Formula: C39H33N2O6P MolecularWeight: 656.662881

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC3=CC=CC=C3C=C2C(=O)C(C4=CC=CC5=CC=CC=C54)P(=O)(O)O)C(=O)C6=CC7=CC=CC=C7C=C6

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC3=CC=CC=C3C=C2C(=O)C(C4=CC=CC5=CC=CC=C54)P(=O)(O)O)C(=O)C6=CC7=CC=CC=C7C=C6

InChI

InChI=1S/C39H33N2O6P/c42-36(37(48(45,46)47)33-15-7-13-26-9-5-6-14-32(26)33)34-23-28-11-3-4-12-29(28)24-35(34)38(43)40-31-18-20-41(21-19-31)39(44)30-17-16-25-8-1-2-10-27(25)22-30/h1-17,22-24,31,37H,18-21H2,(H,40,43)(H2,45,46,47)