(E)-3-(4-chloranyl-3-nitro-phenyl)-N-[4-(4-methylpiperidin-1-yl)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(4-chloranyl-3-nitro-phenyl)-N-[4-(4-methylpiperidin-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-3-(4-chloro-3-nitro-phenyl)-N-[4-(4-methyl-1-piperidyl)phenyl]prop-2-enamide CAS Name: (E)-3-(4-chloro-3-nitrophenyl)-N-[4-(4-methyl-1-piperidinyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(4-chloro-3-nitrophenyl)-N-[4-(4-methylpiperidin-1-yl)phenyl]prop-2-enamide Traditional Name: (E)-3-(4-chloro-3-nitro-phenyl)-N-[4-(4-methylpiperidino)phenyl]acrylamide Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC=C(C=C2)NC(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=CC=C(C=C2)NC(=O)/C=C/C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H22ClN3O3/c1-15-10-12-24(13-11-15)18-6-4-17(5-7-18)23-21(26)9-3-16-2-8-19(22)20(14-16)25(27)28/h2-9,14-15H,10-13H2,1H3,(H,23,26)/b9-3+