4-[3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoylamino]-N,N-diethyl-benzamide

Systemtic Name: 4-[3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoylamino]-N,N-diethyl-benzamide Openeye Name: 4-[3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoylamino]-N,N-diethyl-benzamide CAS Name: 4-[[3-(7-chloro-1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]amino]-N,N-diethylbenzamide IUPAC Name: 4-[3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoylamino]-N,N-diethylbenzamide Traditional Name: 4-[[3-(7-chloro-1,3-benzodioxol-5-yl)acryloyl]amino]-N,N-diethyl-benzamide Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC3=C(C(=C2)Cl)OCO3

InChI

InChI=1S/C21H21ClN2O4/c1-3-24(4-2)21(26)15-6-8-16(9-7-15)23-19(25)10-5-14-11-17(22)20-18(12-14)27-13-28-20/h5-12H,3-4,13H2,1-2H3,(H,23,25)