6-[cyclohexyl-[4-(2-methanoyl-3-nitro-phenoxy)butanoyl]amino]hexyl ethanoate

Systemtic Name: 6-[cyclohexyl-[4-(2-methanoyl-3-nitro-phenoxy)butanoyl]amino]hexyl ethanoate Openeye Name: 6-[cyclohexyl-[4-(2-formyl-3-nitro-phenoxy)butanoyl]amino]hexyl acetate CAS Name: acetic acid 6-[cyclohexyl-[4-(2-formyl-3-nitrophenoxy)-1-oxobutyl]amino]hexyl ester IUPAC Name: 6-[cyclohexyl-[4-(2-formyl-3-nitrophenoxy)butanoyl]amino]hexyl acetate Traditional Name: acetic acid 6-[cyclohexyl-[4-(2-formyl-3-nitro-phenoxy)butanoyl]amino]hexyl ester Formula: C25H36N2O7 MolecularWeight: 476.56254

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCCCN(C1CCCCC1)C(=O)CCCOC2=CC=CC(=C2C=O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCCCCCCN(C1CCCCC1)C(=O)CCCOC2=CC=CC(=C2C=O)[N+](=O)[O-]

InChI

InChI=1S/C25H36N2O7/c1-20(29)33-17-8-3-2-7-16-26(21-11-5-4-6-12-21)25(30)15-10-18-34-24-14-9-13-23(27(31)32)22(24)19-28/h9,13-14,19,21H,2-8,10-12,15-18H2,1H3