ethyl 4-[(E)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]prop-2-enoyl]oxybenzoate

Systemtic Name: ethyl 4-[(E)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]prop-2-enoyl]oxybenzoate Openeye Name: ethyl 4-[(E)-3-[4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]prop-2-enoyl]oxybenzoate CAS Name: 4-[(E)-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]-1-oxoprop-2-enoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(E)-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]prop-2-enoyl]oxybenzoate Traditional Name: 4-[(E)-3-[4-(2-amino-2-keto-ethoxy)-3-methoxy-phenyl]acryloyl]oxybenzoic acid ethyl ester Formula: C21H21NO7 MolecularWeight: 399.39394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OC(=O)C=CC2=CC(=C(C=C2)OCC(=O)N)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC(=O)/C=C/C2=CC(=C(C=C2)OCC(=O)N)OC

InChI

InChI=1S/C21H21NO7/c1-3-27-21(25)15-6-8-16(9-7-15)29-20(24)11-5-14-4-10-17(18(12-14)26-2)28-13-19(22)23/h4-12H,3,13H2,1-2H3,(H2,22,23)/b11-5+