9-(4-methoxyphenyl)-7-methyl-[1,3]dioxolo[4,5-h]isoquinolin-8-ium-8-amine

Systemtic Name: 9-(4-methoxyphenyl)-7-methyl-[1,3]dioxolo[4,5-h]isoquinolin-8-ium-8-amine Openeye Name: 9-(4-methoxyphenyl)-7-methyl-[1,3]dioxolo[4,5-h]isoquinolin-8-ium-8-amine CAS Name: 9-(4-methoxyphenyl)-7-methyl-[1,3]dioxolo[4,5-h]isoquinolin-8-ium-8-amine IUPAC Name: 9-(4-methoxyphenyl)-7-methyl-[1,3]dioxolo[4,5-h]isoquinolin-8-ium-8-amine Traditional Name: [9-(4-methoxyphenyl)-7-methyl-[1,3]dioxol[4,5-h]isoquinolin-8-ium-8-yl]amine Formula: C18H17N2O3+ MolecularWeight: 309.33918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=C2C(=C1)C=CC3=C2OCO3)C4=CC=C(C=C4)OC)N

Isomeric SMILES

CC1=[N+](C(=C2C(=C1)C=CC3=C2OCO3)C4=CC=C(C=C4)OC)N

InChI

InChI=1S/C18H17N2O3/c1-11-9-13-5-8-15-18(23-10-22-15)16(13)17(20(11)19)12-3-6-14(21-2)7-4-12/h3-9H,10,19H2,1-2H3/q+1