3-[[(E)-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)prop-2-enoyl]amino]benzamide

Systemtic Name: 3-[[(E)-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)prop-2-enoyl]amino]benzamide Openeye Name: 3-[[(E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)prop-2-enoyl]amino]benzamide CAS Name: 3-[[(E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-oxoprop-2-enyl]amino]benzamide IUPAC Name: 3-[[(E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)prop-2-enoyl]amino]benzamide Traditional Name: 3-[[(E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acryloyl]amino]benzamide Formula: C19H17ClN2O4 MolecularWeight: 372.80228

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C=CC(=O)NC3=CC=CC(=C3)C(=O)N)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)/C=C/C(=O)NC3=CC=CC(=C3)C(=O)N)Cl)OC1

InChI

InChI=1S/C19H17ClN2O4/c20-15-9-12(10-16-18(15)26-8-2-7-25-16)5-6-17(23)22-14-4-1-3-13(11-14)19(21)24/h1,3-6,9-11H,2,7-8H2,(H2,21,24)(H,22,23)/b6-5+