cyclohexanamine; (2E)-2-[3-(4-propan-2-yloxyphenyl)cyclohexylidene]ethanoic acid

Systemtic Name: cyclohexanamine; (2E)-2-[3-(4-propan-2-yloxyphenyl)cyclohexylidene]ethanoic acid Openeye Name: cyclohexanamine; (2E)-2-[3-(4-isopropoxyphenyl)cyclohexylidene]acetic acid CAS Name: cyclohexanamine; (2E)-2-[3-(4-propan-2-yloxyphenyl)cyclohexylidene]acetic acid IUPAC Name: cyclohexanamine; (2E)-2-[3-(4-propan-2-yloxyphenyl)cyclohexylidene]acetic acid Traditional Name: cyclohexylamine; (2E)-2-[3-(4-isopropoxyphenyl)cyclohexylidene]acetic acid Formula: C23H35NO3 MolecularWeight: 373.5289

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C2CCCC(=CC(=O)O)C2.C1CCC(CC1)N

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C2CCC/C(=C\C(=O)O)/C2.C1CCC(CC1)N

InChI

InChI=1S/C17H22O3.C6H13N/c1-12(2)20-16-8-6-14(7-9-16)15-5-3-4-13(10-15)11-17(18)19;7-6-4-2-1-3-5-6/h6-9,11-12,15H,3-5,10H2,1-2H3,(H,18,19);6H,1-5,7H2/b13-11+;