3-[[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]amino]-N,N-diethyl-benzamide

Systemtic Name: 3-[[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]amino]-N,N-diethyl-benzamide Openeye Name: 3-[[(E)-3-(5-bromo-2-methoxy-phenyl)prop-2-enoyl]amino]-N,N-diethyl-benzamide CAS Name: 3-[[(E)-3-(5-bromo-2-methoxyphenyl)-1-oxoprop-2-enyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[[(E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[(E)-3-(5-bromo-2-methoxy-phenyl)acryloyl]amino]-N,N-diethyl-benzamide Formula: C21H23BrN2O3 MolecularWeight: 431.32292

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C=CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)/C=C/C2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C21H23BrN2O3/c1-4-24(5-2)21(26)16-7-6-8-18(14-16)23-20(25)12-9-15-13-17(22)10-11-19(15)27-3/h6-14H,4-5H2,1-3H3,(H,23,25)/b12-9+