(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-[2-(4-methoxyphenyl)ethyl]azanium

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-[2-(4-methoxyphenyl)ethyl]azanium Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-[2-(4-methoxyphenyl)ethyl]ammonium CAS Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-[2-(4-methoxyphenyl)ethyl]ammonium IUPAC Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-[2-(4-methoxyphenyl)ethyl]azanium Traditional Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-[2-(4-methoxyphenyl)ethyl]ammonium Formula: C18H21ClNO3+ MolecularWeight: 334.81724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC[NH2+]CC2=CC3=C(C(=C2)Cl)OCCO3

Isomeric SMILES

COC1=CC=C(C=C1)CC[NH2+]CC2=CC3=C(C(=C2)Cl)OCCO3

InChI

InChI=1S/C18H20ClNO3/c1-21-15-4-2-13(3-5-15)6-7-20-12-14-10-16(19)18-17(11-14)22-8-9-23-18/h2-5,10-11,20H,6-9,12H2,1H3/p+1