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

Systemtic Name: (E)-3-(4-chloranyl-3-nitro-phenyl)-N-[4-(piperidin-1-ylmethyl)phenyl]prop-2-enamide Openeye Name: (E)-3-(4-chloro-3-nitro-phenyl)-N-[4-(1-piperidylmethyl)phenyl]prop-2-enamide CAS Name: (E)-3-(4-chloro-3-nitrophenyl)-N-[4-(1-piperidinylmethyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(4-chloro-3-nitrophenyl)-N-[4-(piperidin-1-ylmethyl)phenyl]prop-2-enamide Traditional Name: (E)-3-(4-chloro-3-nitro-phenyl)-N-[4-(piperidinomethyl)phenyl]acrylamide Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)/C=C/C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H22ClN3O3/c22-19-10-6-16(14-20(19)25(27)28)7-11-21(26)23-18-8-4-17(5-9-18)15-24-12-2-1-3-13-24/h4-11,14H,1-3,12-13,15H2,(H,23,26)/b11-7+