cyclohexanamine; 2-(4-methoxyphenyl)ethanoic acid; 4-nitrobenzaldehyde

Systemtic Name: cyclohexanamine; 2-(4-methoxyphenyl)ethanoic acid; 4-nitrobenzaldehyde Openeye Name: cyclohexanamine; 2-(4-methoxyphenyl)acetic acid; 4-nitrobenzaldehyde CAS Name: cyclohexanamine; 2-(4-methoxyphenyl)acetic acid; 4-nitrobenzaldehyde IUPAC Name: cyclohexanamine; 2-(4-methoxyphenyl)acetic acid; 4-nitrobenzaldehyde Traditional Name: cyclohexylamine; 2-(4-methoxyphenyl)acetic acid; 4-nitrobenzaldehyde Formula: C22H28N2O6 MolecularWeight: 416.46752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)O.C1CCC(CC1)N.C1=CC(=CC=C1C=O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)O.C1CCC(CC1)N.C1=CC(=CC=C1C=O)[N+](=O)[O-]

InChI

InChI=1S/C9H10O3.C7H5NO3.C6H13N/c1-12-8-4-2-7(3-5-8)6-9(10)11;9-5-6-1-3-7(4-2-6)8(10)11;7-6-4-2-1-3-5-6/h2-5H,6H2,1H3,(H,10,11);1-5H;6H,1-5,7H2