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

Systemtic Name: methyl 4-[3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]propanoylamino]benzoate Openeye Name: methyl 4-[3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]propanoylamino]benzoate CAS Name: 4-[[3-[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]propanoylamino]benzoate Traditional Name: 4-[3-[[(E)-3-(4-methoxyphenyl)acryloyl]amino]propanoylamino]benzoic acid methyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NCCC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)NCCC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C21H22N2O5/c1-27-18-10-3-15(4-11-18)5-12-19(24)22-14-13-20(25)23-17-8-6-16(7-9-17)21(26)28-2/h3-12H,13-14H2,1-2H3,(H,22,24)(H,23,25)/b12-5+