N-[3-[(2-chloranyl-4-nitro-phenyl)amino]-2,2-dimethyl-propyl]-4-propan-2-yloxy-benzamide

Systemtic Name: N-[3-[(2-chloranyl-4-nitro-phenyl)amino]-2,2-dimethyl-propyl]-4-propan-2-yloxy-benzamide Openeye Name: N-[3-(2-chloro-4-nitro-anilino)-2,2-dimethyl-propyl]-4-isopropoxy-benzamide CAS Name: N-[3-(2-chloro-4-nitroanilino)-2,2-dimethylpropyl]-4-propan-2-yloxybenzamide IUPAC Name: N-[3-(2-chloro-4-nitroanilino)-2,2-dimethylpropyl]-4-propan-2-yloxybenzamide Traditional Name: N-[3-(2-chloro-4-nitro-anilino)-2,2-dimethyl-propyl]-4-isopropoxy-benzamide Formula: C21H26ClN3O4 MolecularWeight: 419.90184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NCC(C)(C)CNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NCC(C)(C)CNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H26ClN3O4/c1-14(2)29-17-8-5-15(6-9-17)20(26)24-13-21(3,4)12-23-19-10-7-16(25(27)28)11-18(19)22/h5-11,14,23H,12-13H2,1-4H3,(H,24,26)