1-[3-methoxy-6-methyl-5-(2-methylpropyl)-4-oxidanidyl-2H-pyrazin-4-ium-1-yl]indole-5-carbonitrile

Systemtic Name: 1-[3-methoxy-6-methyl-5-(2-methylpropyl)-4-oxidanidyl-2H-pyrazin-4-ium-1-yl]indole-5-carbonitrile Openeye Name: 1-(5-isobutyl-3-methoxy-6-methyl-4-oxido-2H-pyrazin-4-ium-1-yl)indole-5-carbonitrile CAS Name: 1-[3-methoxy-6-methyl-5-(2-methylpropyl)-4-oxido-2H-pyrazin-4-ium-1-yl]-5-indolecarbonitrile IUPAC Name: 1-[3-methoxy-6-methyl-5-(2-methylpropyl)-4-oxido-2H-pyrazin-4-ium-1-yl]indole-5-carbonitrile Traditional Name: 1-(5-isobutyl-3-methoxy-6-methyl-4-oxido-2H-pyrazin-4-ium-1-yl)indole-5-carbonitrile Formula: C19H22N4O2 MolecularWeight: 338.40358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=C(CN1N2C=CC3=C2C=CC(=C3)C#N)OC)[O-])CC(C)C

Isomeric SMILES

CC1=C([N+](=C(CN1N2C=CC3=C2C=CC(=C3)C#N)OC)[O-])CC(C)C

InChI

InChI=1S/C19H22N4O2/c1-13(2)9-18-14(3)22(12-19(25-4)23(18)24)21-8-7-16-10-15(11-20)5-6-17(16)21/h5-8,10,13H,9,12H2,1-4H3