methyl 3-[2-isocyanato-1-methoxy-3-(4-nitrophenyl)-1-oxidanylidene-propan-2-yl]-2,2-dimethyl-cyclobutane-1-carboxylate

Systemtic Name: methyl 3-[2-isocyanato-1-methoxy-3-(4-nitrophenyl)-1-oxidanylidene-propan-2-yl]-2,2-dimethyl-cyclobutane-1-carboxylate Openeye Name: methyl 3-[1-isocyanato-2-methoxy-1-[(4-nitrophenyl)methyl]-2-oxo-ethyl]-2,2-dimethyl-cyclobutanecarboxylate CAS Name: 3-[2-isocyanato-1-methoxy-3-(4-nitrophenyl)-1-oxopropan-2-yl]-2,2-dimethyl-1-cyclobutanecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-isocyanato-1-methoxy-3-(4-nitrophenyl)-1-oxopropan-2-yl]-2,2-dimethylcyclobutane-1-carboxylate Traditional Name: 3-[1-isocyanato-2-keto-2-methoxy-1-(4-nitrobenzyl)ethyl]-2,2-dimethyl-cyclobutanecarboxylic acid methyl ester Formula: C19H22N2O7 MolecularWeight: 390.38718

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC1C(CC2=CC=C(C=C2)[N+](=O)[O-])(C(=O)OC)N=C=O)C(=O)OC)C

Isomeric SMILES

CC1(C(CC1C(CC2=CC=C(C=C2)[N+](=O)[O-])(C(=O)OC)N=C=O)C(=O)OC)C

InChI

InChI=1S/C19H22N2O7/c1-18(2)14(16(23)27-3)9-15(18)19(20-11-22,17(24)28-4)10-12-5-7-13(8-6-12)21(25)26/h5-8,14-15H,9-10H2,1-4H3