4-methoxy-6-pentyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium

Systemtic Name: 4-methoxy-6-pentyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium Openeye Name: 4-methoxy-6-pentyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium CAS Name: 4-methoxy-6-pentyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium IUPAC Name: 4-methoxy-6-pentyl-[1,3]dioxolo[4,5-g]isoquinolin-6-ium Traditional Name: 6-amyl-4-methoxy-[1,3]dioxol[4,5-g]isoquinolin-6-ium Formula: C16H20NO3+ MolecularWeight: 274.3349

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+]1=CC2=C(C3=C(C=C2C=C1)OCO3)OC

Isomeric SMILES

CCCCC[N+]1=CC2=C(C3=C(C=C2C=C1)OCO3)OC

InChI

InChI=1S/C16H20NO3/c1-3-4-5-7-17-8-6-12-9-14-16(20-11-19-14)15(18-2)13(12)10-17/h6,8-10H,3-5,7,11H2,1-2H3/q+1