4-[2-(4-methylcyclohex-3-en-1-yl)ethylamino]benzoic acid

Systemtic Name: 4-[2-(4-methylcyclohex-3-en-1-yl)ethylamino]benzoic acid Openeye Name: 4-[2-(4-methylcyclohex-3-en-1-yl)ethylamino]benzoic acid CAS Name: 4-[2-(4-methyl-1-cyclohex-3-enyl)ethylamino]benzoic acid IUPAC Name: 4-[2-(4-methylcyclohex-3-en-1-yl)ethylamino]benzoic acid Traditional Name: 4-[2-(4-methylcyclohex-3-en-1-yl)ethylamino]benzoic acid Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(CC1)CCNC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=CCC(CC1)CCNC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H21NO2/c1-12-2-4-13(5-3-12)10-11-17-15-8-6-14(7-9-15)16(18)19/h2,6-9,13,17H,3-5,10-11H2,1H3,(H,18,19)