3-(1,3-benzodioxol-5-ylmethyl)-6-chloranyl-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-6-chloranyl-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-6-chloro-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-6-chloro-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-6-chloro-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium Traditional Name: 6-chloro-5,7-dimethyl-3-piperonyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium Formula: C18H19ClNO3+ MolecularWeight: 332.80136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C[NH+](CO2)CC3=CC4=C(C=C3)OCO4)C(=C1Cl)C

Isomeric SMILES

CC1=CC2=C(C[NH+](CO2)CC3=CC4=C(C=C3)OCO4)C(=C1Cl)C

InChI

InChI=1S/C18H18ClNO3/c1-11-5-16-14(12(2)18(11)19)8-20(9-21-16)7-13-3-4-15-17(6-13)23-10-22-15/h3-6H,7-10H2,1-2H3/p+1