3-[(4-propan-2-ylphenyl)methyl]azetidin-1-ium

Systemtic Name: 3-[(4-propan-2-ylphenyl)methyl]azetidin-1-ium Openeye Name: 3-[(4-isopropylphenyl)methyl]azetidin-1-ium CAS Name: 3-[(4-propan-2-ylphenyl)methyl]azetidin-1-ium IUPAC Name: 3-[(4-propan-2-ylphenyl)methyl]azetidin-1-ium Traditional Name: 3-(4-isopropylbenzyl)azetidin-1-ium Formula: C13H20N+ MolecularWeight: 190.3046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CC2C[NH2+]C2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CC2C[NH2+]C2

InChI

InChI=1S/C13H19N/c1-10(2)13-5-3-11(4-6-13)7-12-8-14-9-12/h3-6,10,12,14H,7-9H2,1-2H3/p+1