cyclohexanamine; (2E)-2-[3-[4-(2-methylpropyl)phenyl]cyclohex-2-en-1-ylidene]ethanoic acid

Systemtic Name: cyclohexanamine; (2E)-2-[3-[4-(2-methylpropyl)phenyl]cyclohex-2-en-1-ylidene]ethanoic acid Openeye Name: cyclohexanamine; (2E)-2-[3-(4-isobutylphenyl)cyclohex-2-en-1-ylidene]acetic acid CAS Name: cyclohexanamine; (2E)-2-[3-[4-(2-methylpropyl)phenyl]-1-cyclohex-2-enylidene]acetic acid IUPAC Name: cyclohexanamine; (2E)-2-[3-[4-(2-methylpropyl)phenyl]cyclohex-2-en-1-ylidene]acetic acid Traditional Name: cyclohexylamine; (2E)-2-[3-(4-isobutylphenyl)cyclohex-2-en-1-ylidene]acetic acid Formula: C24H35NO2 MolecularWeight: 369.5402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C2=CC(=CC(=O)O)CCC2.C1CCC(CC1)N

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C2=C/C(=C/C(=O)O)/CCC2.C1CCC(CC1)N

InChI

InChI=1S/C18H22O2.C6H13N/c1-13(2)10-14-6-8-16(9-7-14)17-5-3-4-15(11-17)12-18(19)20;7-6-4-2-1-3-5-6/h6-9,11-13H,3-5,10H2,1-2H3,(H,19,20);6H,1-5,7H2/b15-12+;