4-cyclohexyl-N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]aniline

Systemtic Name: 4-cyclohexyl-N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]aniline Openeye Name: 4-cyclohexyl-N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]aniline CAS Name: 4-cyclohexyl-N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]aniline IUPAC Name: 4-cyclohexyl-N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]aniline Traditional Name: (4-cyclohexylphenyl)-[(6-nitro-1,3-benzodioxol-5-yl)methyl]amine Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)NCC3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)NCC3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C20H22N2O4/c23-22(24)18-11-20-19(25-13-26-20)10-16(18)12-21-17-8-6-15(7-9-17)14-4-2-1-3-5-14/h6-11,14,21H,1-5,12-13H2