1-[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-[(E)-3-(4-chloro-3-nitro-phenyl)prop-2-enoyl]-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[(E)-3-(4-chloro-3-nitrophenyl)-1-oxoprop-2-enyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-[(E)-3-(4-chloro-3-nitrophenyl)prop-2-enoyl]-N-phenylpiperidine-3-carboxamide Traditional Name: 1-[(E)-3-(4-chloro-3-nitro-phenyl)acryloyl]-N-phenyl-nipecotamide Formula: C21H20ClN3O4 MolecularWeight: 413.8542

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CC(CN(C1)C(=O)/C=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H20ClN3O4/c22-18-10-8-15(13-19(18)25(28)29)9-11-20(26)24-12-4-5-16(14-24)21(27)23-17-6-2-1-3-7-17/h1-3,6-11,13,16H,4-5,12,14H2,(H,23,27)/b11-9+