(E)-3-[4-[(3-cyclohexylcyclopentyl)amino]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[(3-cyclohexylcyclopentyl)amino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[(3-cyclohexylcyclopentyl)amino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[(3-cyclohexylcyclopentyl)amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[(3-cyclohexylcyclopentyl)amino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[(3-cyclohexylcyclopentyl)amino]phenyl]acrylic acid Formula: C20H27NO2 MolecularWeight: 313.43388

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CCC(C2)NC3=CC=C(C=C3)C=CC(=O)O

Isomeric SMILES

C1CCC(CC1)C2CCC(C2)NC3=CC=C(C=C3)/C=C/C(=O)O

InChI

InChI=1S/C20H27NO2/c22-20(23)13-8-15-6-10-18(11-7-15)21-19-12-9-17(14-19)16-4-2-1-3-5-16/h6-8,10-11,13,16-17,19,21H,1-5,9,12,14H2,(H,22,23)/b13-8+