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

Systemtic Name: [2-[3-[(1-ethanoylpiperidin-4-yl)-methyl-carbamoyl]naphthalen-2-yl]-1-naphthalen-1-yl-2-oxidanylidene-ethyl]phosphonic acid Openeye Name: [2-[3-[(1-acetyl-4-piperidyl)-methyl-carbamoyl]-2-naphthyl]-1-(1-naphthyl)-2-oxo-ethyl]phosphonic acid CAS Name: [2-[3-[[(1-acetyl-4-piperidinyl)-methylamino]-oxomethyl]-2-naphthalenyl]-1-(1-naphthalenyl)-2-oxoethyl]phosphonic acid IUPAC Name: [2-[3-[(1-acetylpiperidin-4-yl)-methylcarbamoyl]naphthalen-2-yl]-1-naphthalen-1-yl-2-oxoethyl]phosphonic acid Traditional Name: [2-[3-[(1-acetyl-4-piperidyl)-methyl-carbamoyl]-2-naphthyl]-2-keto-1-(1-naphthyl)ethyl]phosphonic acid Formula: C31H31N2O6P MolecularWeight: 558.561401

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)N(C)C(=O)C2=CC3=CC=CC=C3C=C2C(=O)C(C4=CC=CC5=CC=CC=C54)P(=O)(O)O

Isomeric SMILES

CC(=O)N1CCC(CC1)N(C)C(=O)C2=CC3=CC=CC=C3C=C2C(=O)C(C4=CC=CC5=CC=CC=C54)P(=O)(O)O

InChI

InChI=1S/C31H31N2O6P/c1-20(34)33-16-14-24(15-17-33)32(2)31(36)28-19-23-10-4-3-9-22(23)18-27(28)29(35)30(40(37,38)39)26-13-7-11-21-8-5-6-12-25(21)26/h3-13,18-19,24,30H,14-17H2,1-2H3,(H2,37,38,39)