azocan-1-yl-(3-nitro-4-piperidin-1-yl-phenyl)methanone

Systemtic Name: azocan-1-yl-(3-nitro-4-piperidin-1-yl-phenyl)methanone Openeye Name: azocan-1-yl-[3-nitro-4-(1-piperidyl)phenyl]methanone CAS Name: 1-azocanyl-[3-nitro-4-(1-piperidinyl)phenyl]methanone IUPAC Name: azocan-1-yl-(3-nitro-4-piperidin-1-ylphenyl)methanone Traditional Name: azocan-1-yl-(3-nitro-4-piperidino-phenyl)methanone Formula: C19H27N3O3 MolecularWeight: 345.43598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CCC1)C(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H27N3O3/c23-19(21-13-5-2-1-3-6-14-21)16-9-10-17(18(15-16)22(24)25)20-11-7-4-8-12-20/h9-10,15H,1-8,11-14H2