[2-oxidanylidene-2-(2-phenoxyethylamino)ethyl] (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(2-phenoxyethylamino)ethyl] (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: [2-oxo-2-(2-phenoxyethylamino)ethyl] (E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-propenoic acid [2-oxo-2-(2-phenoxyethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-phenoxyethylamino)ethyl] (E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)acrylic acid [2-keto-2-(2-phenoxyethylamino)ethyl] ester Formula: C20H18ClNO6 MolecularWeight: 403.81302

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)C=CC(=O)OCC(=O)NCCOC3=CC=CC=C3)Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)/C=C/C(=O)OCC(=O)NCCOC3=CC=CC=C3)Cl

InChI

InChI=1S/C20H18ClNO6/c21-16-10-14(11-17-20(16)28-13-27-17)6-7-19(24)26-12-18(23)22-8-9-25-15-4-2-1-3-5-15/h1-7,10-11H,8-9,12-13H2,(H,22,23)/b7-6+