cyclohexanamine; 2-methylpropanoic acid; 4-nitrobenzaldehyde

Systemtic Name: cyclohexanamine; 2-methylpropanoic acid; 4-nitrobenzaldehyde Openeye Name: cyclohexanamine; 2-methylpropanoic acid; 4-nitrobenzaldehyde CAS Name: cyclohexanamine; 2-methylpropanoic acid; 4-nitrobenzaldehyde IUPAC Name: cyclohexanamine; 2-methylpropanoic acid; 4-nitrobenzaldehyde Traditional Name: cyclohexylamine; isobutyric acid; 4-nitrobenzaldehyde Formula: C17H26N2O5 MolecularWeight: 338.39874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)O.C1CCC(CC1)N.C1=CC(=CC=C1C=O)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)O.C1CCC(CC1)N.C1=CC(=CC=C1C=O)[N+](=O)[O-]

InChI

InChI=1S/C7H5NO3.C6H13N.C4H8O2/c9-5-6-1-3-7(4-2-6)8(10)11;7-6-4-2-1-3-5-6;1-3(2)4(5)6/h1-5H;6H,1-5,7H2;3H,1-2H3,(H,5,6)