cyclohexanamine; ethanoic acid; N-(4-methanoylphenyl)ethanamide

Systemtic Name: cyclohexanamine; ethanoic acid; N-(4-methanoylphenyl)ethanamide Openeye Name: acetic acid; cyclohexanamine; N-(4-formylphenyl)acetamide CAS Name: acetic acid; cyclohexanamine; N-(4-formylphenyl)acetamide IUPAC Name: acetic acid; cyclohexanamine; N-(4-formylphenyl)acetamide Traditional Name: acetic acid; cyclohexylamine; N-(4-formylphenyl)acetamide Formula: C17H26N2O4 MolecularWeight: 322.39934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C=O.CC(=O)O.C1CCC(CC1)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C=O.CC(=O)O.C1CCC(CC1)N

InChI

InChI=1S/C9H9NO2.C6H13N.C2H4O2/c1-7(12)10-9-4-2-8(6-11)3-5-9;7-6-4-2-1-3-5-6;1-2(3)4/h2-6H,1H3,(H,10,12);6H,1-5,7H2;1H3,(H,3,4)