N-[(E)-(3-bromophenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]piperidine-4-carboxamide

Systemtic Name: N-[(E)-(3-bromophenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]piperidine-4-carboxamide Openeye Name: N-[(E)-(3-bromophenyl)methyleneamino]-1-[(4-nitrophenyl)methyl]piperidine-4-carboxamide CAS Name: N-[(E)-(3-bromophenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[(E)-(3-bromophenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]piperidine-4-carboxamide Traditional Name: N-[(E)-(3-bromobenzylidene)amino]-1-(4-nitrobenzyl)isonipecotamide Formula: C20H21BrN4O3 MolecularWeight: 445.30974

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NN=CC2=CC(=CC=C2)Br)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)N/N=C/C2=CC(=CC=C2)Br)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21BrN4O3/c21-18-3-1-2-16(12-18)13-22-23-20(26)17-8-10-24(11-9-17)14-15-4-6-19(7-5-15)25(27)28/h1-7,12-13,17H,8-11,14H2,(H,23,26)/b22-13+