3-[(4-chlorophenyl)methyl]-2-[2-(2-ethylpiperidin-1-yl)-5-nitro-phenyl]-1,3-oxazinane

Systemtic Name: 3-[(4-chlorophenyl)methyl]-2-[2-(2-ethylpiperidin-1-yl)-5-nitro-phenyl]-1,3-oxazinane Openeye Name: 3-[(4-chlorophenyl)methyl]-2-[2-(2-ethyl-1-piperidyl)-5-nitro-phenyl]-1,3-oxazinane CAS Name: 3-[(4-chlorophenyl)methyl]-2-[2-(2-ethyl-1-piperidinyl)-5-nitrophenyl]-1,3-oxazinane IUPAC Name: 3-[(4-chlorophenyl)methyl]-2-[2-(2-ethylpiperidin-1-yl)-5-nitrophenyl]-1,3-oxazinane Traditional Name: 3-(4-chlorobenzyl)-2-[2-(2-ethylpiperidino)-5-nitro-phenyl]-1,3-oxazinane Formula: C24H30ClN3O3 MolecularWeight: 443.9663

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C3N(CCCO3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1CCCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C3N(CCCO3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H30ClN3O3/c1-2-20-6-3-4-14-27(20)23-12-11-21(28(29)30)16-22(23)24-26(13-5-15-31-24)17-18-7-9-19(25)10-8-18/h7-12,16,20,24H,2-6,13-15,17H2,1H3