methyl 2-[[(E)-3-(4-pentylphenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: methyl 2-[[(E)-3-(4-pentylphenyl)prop-2-enoyl]amino]benzoate Openeye Name: methyl 2-[[(E)-3-(4-pentylphenyl)prop-2-enoyl]amino]benzoate CAS Name: 2-[[(E)-1-oxo-3-(4-pentylphenyl)prop-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-(4-pentylphenyl)prop-2-enoyl]amino]benzoate Traditional Name: 2-[[(E)-3-(4-amylphenyl)acryloyl]amino]benzoic acid methyl ester Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C=CC(=O)NC2=CC=CC=C2C(=O)OC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)/C=C/C(=O)NC2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C22H25NO3/c1-3-4-5-8-17-11-13-18(14-12-17)15-16-21(24)23-20-10-7-6-9-19(20)22(25)26-2/h6-7,9-16H,3-5,8H2,1-2H3,(H,23,24)/b16-15+