3-[[(E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enoyl]amino]-N,N-diethyl-benzamide

Systemtic Name: 3-[[(E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enoyl]amino]-N,N-diethyl-benzamide Openeye Name: 3-[[(E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enoyl]amino]-N,N-diethyl-benzamide CAS Name: 3-[[(E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-oxoprop-2-enyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[[(E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enoyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[(E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acryloyl]amino]-N,N-diethyl-benzamide Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C=CC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)/C=C/C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C23H26N2O4/c1-3-25(4-2)23(27)18-7-5-8-19(16-18)24-22(26)12-10-17-9-11-20-21(15-17)29-14-6-13-28-20/h5,7-12,15-16H,3-4,6,13-14H2,1-2H3,(H,24,26)/b12-10+