pentyl 4-[[(E)-2-cyano-3-[4-(phenylcarbonyloxy)phenyl]prop-2-enoyl]amino]benzoate

Systemtic Name: pentyl 4-[[(E)-2-cyano-3-[4-(phenylcarbonyloxy)phenyl]prop-2-enoyl]amino]benzoate Openeye Name: pentyl 4-[[(E)-3-(4-benzoyloxyphenyl)-2-cyano-prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(4-benzoyloxyphenyl)-2-cyano-1-oxoprop-2-enyl]amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-[[(E)-3-(4-benzoyloxyphenyl)-2-cyanoprop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(4-benzoyloxyphenyl)-2-cyano-acryloyl]amino]benzoic acid amyl ester Formula: C29H26N2O5 MolecularWeight: 482.52714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)OC(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)/C(=C/C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C29H26N2O5/c1-2-3-7-18-35-28(33)23-12-14-25(15-13-23)31-27(32)24(20-30)19-21-10-16-26(17-11-21)36-29(34)22-8-5-4-6-9-22/h4-6,8-17,19H,2-3,7,18H2,1H3,(H,31,32)/b24-19+