N-[2-(3,4-dichlorophenyl)-4-oxidanyl-butyl]-N-methyl-3-nitro-naphthalene-1-carboxamide

Systemtic Name: N-[2-(3,4-dichlorophenyl)-4-oxidanyl-butyl]-N-methyl-3-nitro-naphthalene-1-carboxamide Openeye Name: N-[2-(3,4-dichlorophenyl)-4-hydroxy-butyl]-N-methyl-3-nitro-naphthalene-1-carboxamide CAS Name: N-[2-(3,4-dichlorophenyl)-4-hydroxybutyl]-N-methyl-3-nitro-1-naphthalenecarboxamide IUPAC Name: N-[2-(3,4-dichlorophenyl)-4-hydroxybutyl]-N-methyl-3-nitronaphthalene-1-carboxamide Traditional Name: N-[2-(3,4-dichlorophenyl)-4-hydroxy-butyl]-N-methyl-3-nitro-1-naphthamide Formula: C22H20Cl2N2O4 MolecularWeight: 447.3112

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(CCO)C1=CC(=C(C=C1)Cl)Cl)C(=O)C2=CC(=CC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CN(CC(CCO)C1=CC(=C(C=C1)Cl)Cl)C(=O)C2=CC(=CC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C22H20Cl2N2O4/c1-25(13-16(8-9-27)14-6-7-20(23)21(24)11-14)22(28)19-12-17(26(29)30)10-15-4-2-3-5-18(15)19/h2-7,10-12,16,27H,8-9,13H2,1H3