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methyl 2-[4-(methylamino)-3-nitro-1-(phenylcarbonyl)cyclohexyl]ethanoate

methyl 2-[4-(methylamino)-3-nitro-1-(phenylcarbonyl)cyclohexyl]ethanoate

Systemtic Name:methyl 2-[4-(methylamino)-3-nitro-1-(phenylcarbonyl)cyclohexyl]ethanoate
Openeye Name:methyl 2-[1-benzoyl-4-(methylamino)-3-nitro-cyclohexyl]acetate
CAS Name:2-[1-benzoyl-4-(methylamino)-3-nitrocyclohexyl]acetic acid methyl ester
IUPAC Name:methyl 2-[1-benzoyl-4-(methylamino)-3-nitrocyclohexyl]acetate
Traditional Name:2-[1-benzoyl-4-(methylamino)-3-nitro-cyclohexyl]acetic acid methyl ester
Formula: C17H22N2O5
MolecularWeight: 334.36698
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Descriptors Computed from Structure

Canonical SMILES:

CNC1CCC(CC1[N+](=O)[O-])(CC(=O)OC)C(=O)C2=CC=CC=C2


Isomeric SMILES

CNC1CCC(CC1[N+](=O)[O-])(CC(=O)OC)C(=O)C2=CC=CC=C2


InChI

InChI=1S/C17H22N2O5/c1-18-13-8-9-17(11-15(20)24-2,10-14(13)19(22)23)16(21)12-6-4-3-5-7-12/h3-7,13-14,18H,8-11H2,1-2H3


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