6-[2-(1H-indol-3-yl)ethyl]-5-methoxy-3-(2-methylpropyl)-4-oxidanidyl-1H-pyrazin-4-ium-2-one

Systemtic Name: 6-[2-(1H-indol-3-yl)ethyl]-5-methoxy-3-(2-methylpropyl)-4-oxidanidyl-1H-pyrazin-4-ium-2-one Openeye Name: 6-[2-(1H-indol-3-yl)ethyl]-3-isobutyl-5-methoxy-4-oxido-1H-pyrazin-4-ium-2-one CAS Name: 6-[2-(1H-indol-3-yl)ethyl]-5-methoxy-3-(2-methylpropyl)-4-oxido-1H-pyrazin-4-ium-2-one IUPAC Name: 6-[2-(1H-indol-3-yl)ethyl]-5-methoxy-3-(2-methylpropyl)-4-oxido-1H-pyrazin-4-ium-2-one Traditional Name: 6-[2-(1H-indol-3-yl)ethyl]-3-isobutyl-5-methoxy-4-oxido-1H-pyrazin-4-ium-2-one Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=[N+](C(=C(NC1=O)CCC2=CNC3=CC=CC=C32)OC)[O-]

Isomeric SMILES

CC(C)CC1=[N+](C(=C(NC1=O)CCC2=CNC3=CC=CC=C32)OC)[O-]

InChI

InChI=1S/C19H23N3O3/c1-12(2)10-17-18(23)21-16(19(25-3)22(17)24)9-8-13-11-20-15-7-5-4-6-14(13)15/h4-7,11-12,20H,8-10H2,1-3H3,(H,21,23)