[2-(cyclohexylamino)-2-methyl-3-(4-nitrophenyl)carbonyloxy-propyl] 4-nitrobenzoate

Systemtic Name: [2-(cyclohexylamino)-2-methyl-3-(4-nitrophenyl)carbonyloxy-propyl] 4-nitrobenzoate Openeye Name: [2-(cyclohexylamino)-2-methyl-3-(4-nitrobenzoyl)oxy-propyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-(cyclohexylamino)-2-methyl-3-[(4-nitrophenyl)-oxomethoxy]propyl] ester IUPAC Name: [2-(cyclohexylamino)-2-methyl-3-(4-nitrobenzoyl)oxypropyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-(cyclohexylamino)-2-methyl-3-(4-nitrobenzoyl)oxy-propyl] ester Formula: C24H27N3O8 MolecularWeight: 485.48648

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])(COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC3CCCCC3

Isomeric SMILES

CC(COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])(COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC3CCCCC3

InChI

InChI=1S/C24H27N3O8/c1-24(25-19-5-3-2-4-6-19,15-34-22(28)17-7-11-20(12-8-17)26(30)31)16-35-23(29)18-9-13-21(14-10-18)27(32)33/h7-14,19,25H,2-6,15-16H2,1H3