2-[[(E)-3-(4-cyclopentyloxy-3-methoxy-phenyl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 2-[[(E)-3-(4-cyclopentyloxy-3-methoxy-phenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 2-[[(E)-3-[4-(cyclopentoxy)-3-methoxy-phenyl]prop-2-enoyl]amino]benzoic acid CAS Name: 2-[[(E)-3-(4-cyclopentyloxy-3-methoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 2-[[(E)-3-(4-cyclopentyloxy-3-methoxyphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 2-[[(E)-3-[4-(cyclopentoxy)-3-methoxy-phenyl]acryloyl]amino]benzoic acid Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)NC2=CC=CC=C2C(=O)O)OC3CCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)NC2=CC=CC=C2C(=O)O)OC3CCCC3

InChI

InChI=1S/C22H23NO5/c1-27-20-14-15(10-12-19(20)28-16-6-2-3-7-16)11-13-21(24)23-18-9-5-4-8-17(18)22(25)26/h4-5,8-14,16H,2-3,6-7H2,1H3,(H,23,24)(H,25,26)/b13-11+