4-[[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]amino]-N,N-diethyl-benzamide

Systemtic Name: 4-[[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]amino]-N,N-diethyl-benzamide Openeye Name: 4-[[(E)-3-(4-chloro-3-nitro-phenyl)prop-2-enoyl]amino]-N,N-diethyl-benzamide CAS Name: 4-[[(E)-3-(4-chloro-3-nitrophenyl)-1-oxoprop-2-enyl]amino]-N,N-diethylbenzamide IUPAC Name: 4-[[(E)-3-(4-chloro-3-nitrophenyl)prop-2-enoyl]amino]-N,N-diethylbenzamide Traditional Name: 4-[[(E)-3-(4-chloro-3-nitro-phenyl)acryloyl]amino]-N,N-diethyl-benzamide Formula: C20H20ClN3O4 MolecularWeight: 401.8435

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)/C=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H20ClN3O4/c1-3-23(4-2)20(26)15-7-9-16(10-8-15)22-19(25)12-6-14-5-11-17(21)18(13-14)24(27)28/h5-13H,3-4H2,1-2H3,(H,22,25)/b12-6+