N,N-dimethyl-6-(5-nitro-3-phenylmethoxy-indazol-1-yl)hexan-1-amine

Systemtic Name: N,N-dimethyl-6-(5-nitro-3-phenylmethoxy-indazol-1-yl)hexan-1-amine Openeye Name: 6-(3-benzyloxy-5-nitro-indazol-1-yl)-N,N-dimethyl-hexan-1-amine CAS Name: N,N-dimethyl-6-(5-nitro-3-phenylmethoxy-1-indazolyl)-1-hexanamine IUPAC Name: N,N-dimethyl-6-(5-nitro-3-phenylmethoxyindazol-1-yl)hexan-1-amine Traditional Name: 6-(3-benzoxy-5-nitro-indazol-1-yl)hexyl-dimethyl-amine Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCCCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)OCC3=CC=CC=C3

Isomeric SMILES

CN(C)CCCCCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)OCC3=CC=CC=C3

InChI

InChI=1S/C22H28N4O3/c1-24(2)14-8-3-4-9-15-25-21-13-12-19(26(27)28)16-20(21)22(23-25)29-17-18-10-6-5-7-11-18/h5-7,10-13,16H,3-4,8-9,14-15,17H2,1-2H3