[4-[2-[4-(cyclohexylamino)-4-oxidanylidene-butanoyl]oxyethanoyl]phenyl] 4-nitrobenzoate

Systemtic Name: [4-[2-[4-(cyclohexylamino)-4-oxidanylidene-butanoyl]oxyethanoyl]phenyl] 4-nitrobenzoate Openeye Name: [4-[2-[4-(cyclohexylamino)-4-oxo-butanoyl]oxyacetyl]phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-[2-[4-(cyclohexylamino)-1,4-dioxobutoxy]-1-oxoethyl]phenyl] ester IUPAC Name: [4-[2-[4-(cyclohexylamino)-4-oxobutanoyl]oxyacetyl]phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-[2-[4-(cyclohexylamino)-4-keto-butanoyl]oxyacetyl]phenyl] ester Formula: C25H26N2O8 MolecularWeight: 482.48254

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CCC(=O)OCC(=O)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)CCC(=O)OCC(=O)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H26N2O8/c28-22(16-34-24(30)15-14-23(29)26-19-4-2-1-3-5-19)17-8-12-21(13-9-17)35-25(31)18-6-10-20(11-7-18)27(32)33/h6-13,19H,1-5,14-16H2,(H,26,29)