(4-tert-butylphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone

Systemtic Name: (4-tert-butylphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Openeye Name: (4-tert-butylphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone CAS Name: (4-tert-butylphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone IUPAC Name: (4-tert-butylphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Traditional Name: (4-tert-butylphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Formula: C17H27N2O+ MolecularWeight: 275.40908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCC[NH+](CC2)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCC[NH+](CC2)C

InChI

InChI=1S/C17H26N2O/c1-17(2,3)15-8-6-14(7-9-15)16(20)19-11-5-10-18(4)12-13-19/h6-9H,5,10-13H2,1-4H3/p+1