N-[4-[[(5S)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl]amino]phenyl]ethanamide

Systemtic Name: N-[4-[[(5S)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl]amino]phenyl]ethanamide Openeye Name: N-[4-[[(5S)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl]amino]phenyl]acetamide CAS Name: N-[4-[[(5S)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl]amino]phenyl]acetamide IUPAC Name: N-[4-[[(5S)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl]amino]phenyl]acetamide Traditional Name: N-[4-[[(5S)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxol[4,5-g]isoquinolin-6-ium-5-yl]amino]phenyl]acetamide Formula: C20H24N3O4+ MolecularWeight: 370.42226

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC2C3=C(C4=C(C=C3CC[NH+]2C)OCO4)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N[C@@H]2C3=C(C4=C(C=C3CC[NH+]2C)OCO4)OC

InChI

InChI=1S/C20H23N3O4/c1-12(24)21-14-4-6-15(7-5-14)22-20-17-13(8-9-23(20)2)10-16-18(19(17)25-3)27-11-26-16/h4-7,10,20,22H,8-9,11H2,1-3H3,(H,21,24)/p+1/t20-/m0/s1