2-[4-[3,3-diethyl-4-oxidanylidene-1-(1-phenylpropylcarbamoyl)azetidin-2-yl]oxy-3-nitro-phenyl]ethanoic acid

Systemtic Name: 2-[4-[3,3-diethyl-4-oxidanylidene-1-(1-phenylpropylcarbamoyl)azetidin-2-yl]oxy-3-nitro-phenyl]ethanoic acid Openeye Name: 2-[4-[3,3-diethyl-4-oxo-1-(1-phenylpropylcarbamoyl)azetidin-2-yl]oxy-3-nitro-phenyl]acetic acid CAS Name: 2-[4-[[3,3-diethyl-4-oxo-1-[oxo-(1-phenylpropylamino)methyl]-2-azetidinyl]oxy]-3-nitrophenyl]acetic acid IUPAC Name: 2-[4-[3,3-diethyl-4-oxo-1-(1-phenylpropylcarbamoyl)azetidin-2-yl]oxy-3-nitrophenyl]acetic acid Traditional Name: 2-[4-[3,3-diethyl-4-keto-1-(1-phenylpropylcarbamoyl)azetidin-2-yl]oxy-3-nitro-phenyl]acetic acid Formula: C25H29N3O7 MolecularWeight: 483.51366

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=O)N2C(C(C2=O)(CC)CC)OC3=C(C=C(C=C3)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CCC(C1=CC=CC=C1)NC(=O)N2C(C(C2=O)(CC)CC)OC3=C(C=C(C=C3)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C25H29N3O7/c1-4-18(17-10-8-7-9-11-17)26-24(32)27-22(31)25(5-2,6-3)23(27)35-20-13-12-16(15-21(29)30)14-19(20)28(33)34/h7-14,18,23H,4-6,15H2,1-3H3,(H,26,32)(H,29,30)