1-(4-tert-butylphenyl)-N-methyl-methanamine; 1-(4-nitrophenyl)ethanone

Systemtic Name: 1-(4-tert-butylphenyl)-N-methyl-methanamine; 1-(4-nitrophenyl)ethanone Openeye Name: 1-(4-tert-butylphenyl)-N-methyl-methanamine; 1-(4-nitrophenyl)ethanone CAS Name: 1-(4-tert-butylphenyl)-N-methylmethanamine; 1-(4-nitrophenyl)ethanone IUPAC Name: 1-(4-tert-butylphenyl)-N-methylmethanamine; 1-(4-nitrophenyl)ethanone Traditional Name: (4-tert-butylbenzyl)-methyl-amine; 1-(4-nitrophenyl)ethanone Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)[N+](=O)[O-].CC(C)(C)C1=CC=C(C=C1)CNC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)[N+](=O)[O-].CC(C)(C)C1=CC=C(C=C1)CNC

InChI

InChI=1S/C12H19N.C8H7NO3/c1-12(2,3)11-7-5-10(6-8-11)9-13-4;1-6(10)7-2-4-8(5-3-7)9(11)12/h5-8,13H,9H2,1-4H3;2-5H,1H3