N-(2-chloranyl-5-nitro-phenyl)-1-[(3-ethoxyphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-1-[(3-ethoxyphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-1-[(3-ethoxyphenyl)methyl]piperidine-4-carboxamide CAS Name: N-(2-chloro-5-nitrophenyl)-1-[(3-ethoxyphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-1-[(3-ethoxyphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-1-(3-ethoxybenzyl)isonipecotamide Formula: C21H24ClN3O4 MolecularWeight: 417.88596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H24ClN3O4/c1-2-29-18-5-3-4-15(12-18)14-24-10-8-16(9-11-24)21(26)23-20-13-17(25(27)28)6-7-19(20)22/h3-7,12-13,16H,2,8-11,14H2,1H3,(H,23,26)