ethyl 3-[1-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxy-cyclobutyl]-4-nitro-butanoate

Systemtic Name: ethyl 3-[1-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxy-cyclobutyl]-4-nitro-butanoate Openeye Name: ethyl 3-[3-benzyloxy-1-(tert-butoxycarbonylamino)cyclobutyl]-4-nitro-butanoate CAS Name: 3-[1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-phenylmethoxycyclobutyl]-4-nitrobutanoic acid ethyl ester IUPAC Name: ethyl 3-[1-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxycyclobutyl]-4-nitrobutanoate Traditional Name: 3-[3-benzoxy-1-(tert-butoxycarbonylamino)cyclobutyl]-4-nitro-butyric acid ethyl ester Formula: C22H32N2O7 MolecularWeight: 436.49868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C[N+](=O)[O-])C1(CC(C1)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CC(C[N+](=O)[O-])C1(CC(C1)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H32N2O7/c1-5-29-19(25)11-17(14-24(27)28)22(23-20(26)31-21(2,3)4)12-18(13-22)30-15-16-9-7-6-8-10-16/h6-10,17-18H,5,11-15H2,1-4H3,(H,23,26)