3-[[(E)-2-cyano-3-(4-methoxy-3-naphthalen-1-ylcarbonyloxy-phenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: 3-[[(E)-2-cyano-3-(4-methoxy-3-naphthalen-1-ylcarbonyloxy-phenyl)prop-2-enoyl]amino]benzoate Openeye Name: 3-[[(E)-2-cyano-3-[4-methoxy-3-(naphthalene-1-carbonyloxy)phenyl]prop-2-enoyl]amino]benzoate CAS Name: 3-[[(E)-2-cyano-3-[4-methoxy-3-[1-naphthalenyl(oxo)methoxy]phenyl]-1-oxoprop-2-enyl]amino]benzoate IUPAC Name: 3-[[(E)-2-cyano-3-[4-methoxy-3-(naphthalene-1-carbonyloxy)phenyl]prop-2-enoyl]amino]benzoate Traditional Name: 3-[[(E)-2-cyano-3-[4-methoxy-3-(1-naphthoyloxy)phenyl]acryloyl]amino]benzoate Formula: C29H19N2O6- MolecularWeight: 491.47096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC=CC(=C2)C(=O)[O-])OC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=CC(=C2)C(=O)[O-])OC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C29H20N2O6/c1-36-25-13-12-18(14-21(17-30)27(32)31-22-9-4-8-20(16-22)28(33)34)15-26(25)37-29(35)24-11-5-7-19-6-2-3-10-23(19)24/h2-16H,1H3,(H,31,32)(H,33,34)/p-1/b21-14+