4-(3-methyl-4-propan-2-yl-phenoxy)butyl-prop-2-enyl-azanium

Systemtic Name: 4-(3-methyl-4-propan-2-yl-phenoxy)butyl-prop-2-enyl-azanium Openeye Name: allyl-[4-(4-isopropyl-3-methyl-phenoxy)butyl]ammonium CAS Name: 4-(3-methyl-4-propan-2-ylphenoxy)butyl-prop-2-enylammonium IUPAC Name: 4-(3-methyl-4-propan-2-ylphenoxy)butyl-prop-2-enylazanium Traditional Name: allyl-[4-(4-isopropyl-3-methyl-phenoxy)butyl]ammonium Formula: C17H28NO+ MolecularWeight: 262.41032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCC[NH2+]CC=C)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCC[NH2+]CC=C)C(C)C

InChI

InChI=1S/C17H27NO/c1-5-10-18-11-6-7-12-19-16-8-9-17(14(2)3)15(4)13-16/h5,8-9,13-14,18H,1,6-7,10-12H2,2-4H3/p+1