N-[1-(1,3-benzodioxol-5-yl)-3-(butylamino)-3-oxidanylidene-prop-1-en-2-yl]-3-bromanyl-benzamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)-3-(butylamino)-3-oxidanylidene-prop-1-en-2-yl]-3-bromanyl-benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)-1-(butylcarbamoyl)vinyl]-3-bromo-benzamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)-3-(butylamino)-3-oxoprop-1-en-2-yl]-3-bromobenzamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)-3-(butylamino)-3-oxoprop-1-en-2-yl]-3-bromobenzamide Traditional Name: N-[2-(1,3-benzodioxol-5-yl)-1-(butylcarbamoyl)vinyl]-3-bromo-benzamide Formula: C21H21BrN2O4 MolecularWeight: 445.30644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=CC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCCCNC(=O)C(=CC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H21BrN2O4/c1-2-3-9-23-21(26)17(24-20(25)15-5-4-6-16(22)12-15)10-14-7-8-18-19(11-14)28-13-27-18/h4-8,10-12H,2-3,9,13H2,1H3,(H,23,26)(H,24,25)