3-methylbutylidene-piperidin-1-ium-4-yl-(4-propan-2-ylphenyl)azanium

Systemtic Name: 3-methylbutylidene-piperidin-1-ium-4-yl-(4-propan-2-ylphenyl)azanium Openeye Name: (4-isopropylphenyl)-(3-methylbutylidene)-piperidin-1-ium-4-yl-ammonium CAS Name: 3-methylbutylidene-(4-piperidin-1-iumyl)-(4-propan-2-ylphenyl)ammonium IUPAC Name: 3-methylbutylidene-piperidin-1-ium-4-yl-(4-propan-2-ylphenyl)azanium Traditional Name: 3-methylbutylidene-p-cumenyl-piperidin-1-ium-4-yl-ammonium Formula: C19H32N2+2 MolecularWeight: 288.47078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC=[N+](C1CC[NH2+]CC1)C2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC(C)CC=[N+](C1CC[NH2+]CC1)C2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C19H31N2/c1-15(2)11-14-21(19-9-12-20-13-10-19)18-7-5-17(6-8-18)16(3)4/h5-8,14-16,19-20H,9-13H2,1-4H3/q+1/p+1