(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)methyl-methyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: (6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)methyl-methyl-[(4-methylphenyl)methyl]azanium Openeye Name: (6-chloro-2-oxo-1,3-benzoxazol-3-yl)methyl-methyl-(p-tolylmethyl)ammonium CAS Name: (6-chloro-2-oxo-1,3-benzoxazol-3-yl)methyl-methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: (6-chloro-2-oxo-1,3-benzoxazol-3-yl)methyl-methyl-[(4-methylphenyl)methyl]azanium Traditional Name: (6-chloro-2-keto-1,3-benzoxazol-3-yl)methyl-methyl-(4-methylbenzyl)ammonium Formula: C17H18ClN2O2+ MolecularWeight: 317.79002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+](C)CN2C3=C(C=C(C=C3)Cl)OC2=O

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+](C)CN2C3=C(C=C(C=C3)Cl)OC2=O

InChI

InChI=1S/C17H17ClN2O2/c1-12-3-5-13(6-4-12)10-19(2)11-20-15-8-7-14(18)9-16(15)22-17(20)21/h3-9H,10-11H2,1-2H3/p+1