3-methoxy-5-(2-methylpropyl)-4-oxidanidyl-6-oxidanylidene-N-[2-(2-oxidanylideneindol-3-yl)ethyl]-1H-pyrazin-4-ium-2-carboxamide

Systemtic Name: 3-methoxy-5-(2-methylpropyl)-4-oxidanidyl-6-oxidanylidene-N-[2-(2-oxidanylideneindol-3-yl)ethyl]-1H-pyrazin-4-ium-2-carboxamide Openeye Name: 5-isobutyl-3-methoxy-4-oxido-6-oxo-N-[2-(2-oxoindol-3-yl)ethyl]-1H-pyrazin-4-ium-2-carboxamide CAS Name: 3-methoxy-5-(2-methylpropyl)-4-oxido-6-oxo-N-[2-(2-oxo-3-indolyl)ethyl]-1H-pyrazin-4-ium-2-carboxamide IUPAC Name: 3-methoxy-5-(2-methylpropyl)-4-oxido-6-oxo-N-[2-(2-oxoindol-3-yl)ethyl]-1H-pyrazin-4-ium-2-carboxamide Traditional Name: 5-isobutyl-6-keto-N-[2-(2-ketoindol-3-yl)ethyl]-3-methoxy-4-oxido-1H-pyrazin-4-ium-2-carboxamide Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=[N+](C(=C(NC1=O)C(=O)NCCC2=C3C=CC=CC3=NC2=O)OC)[O-]

Isomeric SMILES

CC(C)CC1=[N+](C(=C(NC1=O)C(=O)NCCC2=C3C=CC=CC3=NC2=O)OC)[O-]

InChI

InChI=1S/C20H22N4O5/c1-11(2)10-15-18(26)23-16(20(29-3)24(15)28)19(27)21-9-8-13-12-6-4-5-7-14(12)22-17(13)25/h4-7,11H,8-10H2,1-3H3,(H,21,27)(H,23,26)