2-[(2-bromanyl-4-methyl-phenyl)amino]-N-[(E)-(5-nitro-2-piperidin-1-yl-phenyl)methylideneamino]ethanamide

Systemtic Name: 2-[(2-bromanyl-4-methyl-phenyl)amino]-N-[(E)-(5-nitro-2-piperidin-1-yl-phenyl)methylideneamino]ethanamide Openeye Name: 2-(2-bromo-4-methyl-anilino)-N-[(E)-[5-nitro-2-(1-piperidyl)phenyl]methyleneamino]acetamide CAS Name: 2-(2-bromo-4-methylanilino)-N-[(E)-[5-nitro-2-(1-piperidinyl)phenyl]methylideneamino]acetamide IUPAC Name: 2-(2-bromo-4-methylanilino)-N-[(E)-(5-nitro-2-piperidin-1-ylphenyl)methylideneamino]acetamide Traditional Name: 2-(2-bromo-4-methyl-anilino)-N-[(E)-(5-nitro-2-piperidino-benzylidene)amino]acetamide Formula: C21H24BrN5O3 MolecularWeight: 474.35096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NCC(=O)NN=CC2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NCC(=O)N/N=C/C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3)Br

InChI

InChI=1S/C21H24BrN5O3/c1-15-5-7-19(18(22)11-15)23-14-21(28)25-24-13-16-12-17(27(29)30)6-8-20(16)26-9-3-2-4-10-26/h5-8,11-13,23H,2-4,9-10,14H2,1H3,(H,25,28)/b24-13+