[2-(1-imidazol-1-ylethenyl)phenyl] (E)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]prop-2-enoate

Systemtic Name: [2-(1-imidazol-1-ylethenyl)phenyl] (E)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]prop-2-enoate Openeye Name: [2-(1-imidazol-1-ylvinyl)phenyl] (E)-3-[4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]-2-propenoic acid [2-[1-(1-imidazolyl)ethenyl]phenyl] ester IUPAC Name: [2-(1-imidazol-1-ylethenyl)phenyl] (E)-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[4-(2-amino-2-keto-ethoxy)-3-methoxy-phenyl]acrylic acid [2-(1-imidazol-1-ylvinyl)phenyl] ester Formula: C23H21N3O5 MolecularWeight: 419.42994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OC2=CC=CC=C2C(=C)N3C=CN=C3)OCC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)OC2=CC=CC=C2C(=C)N3C=CN=C3)OCC(=O)N

InChI

InChI=1S/C23H21N3O5/c1-16(26-12-11-25-15-26)18-5-3-4-6-19(18)31-23(28)10-8-17-7-9-20(21(13-17)29-2)30-14-22(24)27/h3-13,15H,1,14H2,2H3,(H2,24,27)/b10-8+