[2-[3-[(4-tert-butylcyclohexyl)methylcarbamoyl]naphthalen-2-yl]-1-naphthalen-1-yl-2-oxidanylidene-ethyl]phosphonic acid

Systemtic Name: [2-[3-[(4-tert-butylcyclohexyl)methylcarbamoyl]naphthalen-2-yl]-1-naphthalen-1-yl-2-oxidanylidene-ethyl]phosphonic acid Openeye Name: [2-[3-[(4-tert-butylcyclohexyl)methylcarbamoyl]-2-naphthyl]-1-(1-naphthyl)-2-oxo-ethyl]phosphonic acid CAS Name: [2-[3-[[(4-tert-butylcyclohexyl)methylamino]-oxomethyl]-2-naphthalenyl]-1-(1-naphthalenyl)-2-oxoethyl]phosphonic acid IUPAC Name: [2-[3-[(4-tert-butylcyclohexyl)methylcarbamoyl]naphthalen-2-yl]-1-naphthalen-1-yl-2-oxoethyl]phosphonic acid Traditional Name: [2-[3-[(4-tert-butylcyclohexyl)methylcarbamoyl]-2-naphthyl]-2-keto-1-(1-naphthyl)ethyl]phosphonic acid Formula: C34H38NO5P MolecularWeight: 571.642981

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)CNC(=O)C2=CC3=CC=CC=C3C=C2C(=O)C(C4=CC=CC5=CC=CC=C54)P(=O)(O)O

Isomeric SMILES

CC(C)(C)C1CCC(CC1)CNC(=O)C2=CC3=CC=CC=C3C=C2C(=O)C(C4=CC=CC5=CC=CC=C54)P(=O)(O)O

InChI

InChI=1S/C34H38NO5P/c1-34(2,3)26-17-15-22(16-18-26)21-35-33(37)30-20-25-11-5-4-10-24(25)19-29(30)31(36)32(41(38,39)40)28-14-8-12-23-9-6-7-13-27(23)28/h4-14,19-20,22,26,32H,15-18,21H2,1-3H3,(H,35,37)(H2,38,39,40)