[2-[4-(hexanoylamino)phenyl]-2-oxidanylidene-ethyl] (E)-3-(furan-2-yl)prop-2-enoate

Systemtic Name: [2-[4-(hexanoylamino)phenyl]-2-oxidanylidene-ethyl] (E)-3-(furan-2-yl)prop-2-enoate Openeye Name: [2-[4-(hexanoylamino)phenyl]-2-oxo-ethyl] (E)-3-(2-furyl)prop-2-enoate CAS Name: (E)-3-(2-furanyl)-2-propenoic acid [2-oxo-2-[4-(1-oxohexylamino)phenyl]ethyl] ester IUPAC Name: [2-[4-(hexanoylamino)phenyl]-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate Traditional Name: (E)-3-(2-furyl)acrylic acid [2-[4-(caproylamino)phenyl]-2-keto-ethyl] ester Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C=CC2=CC=CO2

Isomeric SMILES

CCCCCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)/C=C/C2=CC=CO2

InChI

InChI=1S/C21H23NO5/c1-2-3-4-7-20(24)22-17-10-8-16(9-11-17)19(23)15-27-21(25)13-12-18-6-5-14-26-18/h5-6,8-14H,2-4,7,15H2,1H3,(H,22,24)/b13-12+