phenyl 4-[[(E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoyl]amino]-2-oxidanyl-benzoate

Systemtic Name: phenyl 4-[[(E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoyl]amino]-2-oxidanyl-benzoate Openeye Name: phenyl 2-hydroxy-4-[[(E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoyl]amino]benzoate CAS Name: 2-hydroxy-4-[[(E)-3-(3-methoxy-4-propoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid phenyl ester IUPAC Name: phenyl 2-hydroxy-4-[[(E)-3-(3-methoxy-4-propoxyphenyl)prop-2-enoyl]amino]benzoate Traditional Name: 2-hydroxy-4-[[(E)-3-(3-methoxy-4-propoxy-phenyl)acryloyl]amino]benzoic acid phenyl ester Formula: C26H25NO6 MolecularWeight: 447.4798

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)NC2=CC(=C(C=C2)C(=O)OC3=CC=CC=C3)O)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C(=O)NC2=CC(=C(C=C2)C(=O)OC3=CC=CC=C3)O)OC

InChI

InChI=1S/C26H25NO6/c1-3-15-32-23-13-9-18(16-24(23)31-2)10-14-25(29)27-19-11-12-21(22(28)17-19)26(30)33-20-7-5-4-6-8-20/h4-14,16-17,28H,3,15H2,1-2H3,(H,27,29)/b14-10+