[2-cyclohexyl-2-(methylamino)propyl] 4-nitrobenzoate hydrochloride

Systemtic Name: [2-cyclohexyl-2-(methylamino)propyl] 4-nitrobenzoate hydrochloride Openeye Name: [2-cyclohexyl-2-(methylamino)propyl] 4-nitrobenzoate hydrochloride CAS Name: 4-nitrobenzoic acid [2-cyclohexyl-2-(methylamino)propyl] ester hydrochloride IUPAC Name: [2-cyclohexyl-2-(methylamino)propyl] 4-nitrobenzoate hydrochloride Traditional Name: 4-nitrobenzoic acid [2-cyclohexyl-2-(methylamino)propyl] ester hydrochloride Formula: C17H25ClN2O4 MolecularWeight: 356.8444

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])(C2CCCCC2)NC.Cl

Isomeric SMILES

CC(COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])(C2CCCCC2)NC.Cl

InChI

InChI=1S/C17H24N2O4.ClH/c1-17(18-2,14-6-4-3-5-7-14)12-23-16(20)13-8-10-15(11-9-13)19(21)22;/h8-11,14,18H,3-7,12H2,1-2H3;1H