2,6-dimethylheptan-4-yl-[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]azanium

Systemtic Name: 2,6-dimethylheptan-4-yl-[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]azanium Openeye Name: (1-isobutyl-3-methyl-butyl)-[(4S)-4,5,6,7-tetrahydrobenzofuran-4-yl]ammonium CAS Name: 2,6-dimethylheptan-4-yl-[(4S)-4,5,6,7-tetrahydrobenzofuran-4-yl]ammonium IUPAC Name: 2,6-dimethylheptan-4-yl-[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]azanium Traditional Name: (1-isobutyl-3-methyl-butyl)-[(4S)-4,5,6,7-tetrahydrobenzofuran-4-yl]ammonium Formula: C17H30NO+ MolecularWeight: 264.4262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(C)C)[NH2+]C1CCCC2=C1C=CO2

Isomeric SMILES

CC(C)CC(CC(C)C)[NH2+][C@H]1CCCC2=C1C=CO2

InChI

InChI=1S/C17H29NO/c1-12(2)10-14(11-13(3)4)18-16-6-5-7-17-15(16)8-9-19-17/h8-9,12-14,16,18H,5-7,10-11H2,1-4H3/p+1/t16-/m0/s1