(4-chlorophenyl)methyl-methyl-[(6-oxidanyl-1,3-benzodioxol-5-yl)methyl]azanium

Systemtic Name: (4-chlorophenyl)methyl-methyl-[(6-oxidanyl-1,3-benzodioxol-5-yl)methyl]azanium Openeye Name: (4-chlorophenyl)methyl-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]-methyl-ammonium CAS Name: (4-chlorophenyl)methyl-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]-methylammonium IUPAC Name: (4-chlorophenyl)methyl-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]-methylazanium Traditional Name: (4-chlorobenzyl)-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]-methyl-ammonium Formula: C16H17ClNO3+ MolecularWeight: 306.76408

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)Cl)CC2=CC3=C(C=C2O)OCO3

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)Cl)CC2=CC3=C(C=C2O)OCO3

InChI

InChI=1S/C16H16ClNO3/c1-18(8-11-2-4-13(17)5-3-11)9-12-6-15-16(7-14(12)19)21-10-20-15/h2-7,19H,8-10H2,1H3/p+1