cyclohexanamine; (2Z)-2-[5-(4-methoxyphenyl)cyclohex-2-en-1-ylidene]ethanoic acid

Systemtic Name: cyclohexanamine; (2Z)-2-[5-(4-methoxyphenyl)cyclohex-2-en-1-ylidene]ethanoic acid Openeye Name: cyclohexanamine; (2Z)-2-[5-(4-methoxyphenyl)cyclohex-2-en-1-ylidene]acetic acid CAS Name: cyclohexanamine; (2Z)-2-[5-(4-methoxyphenyl)-1-cyclohex-2-enylidene]acetic acid IUPAC Name: cyclohexanamine; (2Z)-2-[5-(4-methoxyphenyl)cyclohex-2-en-1-ylidene]acetic acid Traditional Name: cyclohexylamine; (2Z)-2-[5-(4-methoxyphenyl)cyclohex-2-en-1-ylidene]acetic acid Formula: C21H29NO3 MolecularWeight: 343.45986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC=CC(=CC(=O)O)C2.C1CCC(CC1)N

Isomeric SMILES

COC1=CC=C(C=C1)C2CC=C/C(=C\C(=O)O)/C2.C1CCC(CC1)N

InChI

InChI=1S/C15H16O3.C6H13N/c1-18-14-7-5-12(6-8-14)13-4-2-3-11(9-13)10-15(16)17;7-6-4-2-1-3-5-6/h2-3,5-8,10,13H,4,9H2,1H3,(H,16,17);6H,1-5,7H2/b11-10+;