[1-(2-naphthalen-1-ylethylcarbamoyl)-3-[phenethyl-(4-pyridin-2-ylphenyl)amino]azetidin-3-yl]phosphonic acid

Systemtic Name: [1-(2-naphthalen-1-ylethylcarbamoyl)-3-[phenethyl-(4-pyridin-2-ylphenyl)amino]azetidin-3-yl]phosphonic acid Openeye Name: [1-[2-(1-naphthyl)ethylcarbamoyl]-3-[N-phenethyl-4-(2-pyridyl)anilino]azetidin-3-yl]phosphonic acid CAS Name: [1-[[2-(1-naphthalenyl)ethylamino]-oxomethyl]-3-[N-phenethyl-4-(2-pyridinyl)anilino]-3-azetidinyl]phosphonic acid IUPAC Name: [1-(2-naphthalen-1-ylethylcarbamoyl)-3-(N-phenethyl-4-pyridin-2-ylanilino)azetidin-3-yl]phosphonic acid Traditional Name: [1-[2-(1-naphthyl)ethylcarbamoyl]-3-[N-phenethyl-4-(2-pyridyl)anilino]azetidin-3-yl]phosphonic acid Formula: C35H35N4O4P MolecularWeight: 606.650561

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN1C(=O)NCCC2=CC=CC3=CC=CC=C32)(N(CCC4=CC=CC=C4)C5=CC=C(C=C5)C6=CC=CC=N6)P(=O)(O)O

Isomeric SMILES

C1C(CN1C(=O)NCCC2=CC=CC3=CC=CC=C32)(N(CCC4=CC=CC=C4)C5=CC=C(C=C5)C6=CC=CC=N6)P(=O)(O)O

InChI

InChI=1S/C35H35N4O4P/c40-34(37-23-20-29-13-8-12-28-11-4-5-14-32(28)29)38-25-35(26-38,44(41,42)43)39(24-21-27-9-2-1-3-10-27)31-18-16-30(17-19-31)33-15-6-7-22-36-33/h1-19,22H,20-21,23-26H2,(H,37,40)(H2,41,42,43)