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

Systemtic Name: 3-methoxy-N-[(3-methoxyphenyl)methyl]-5-(2-methylpropyl)-4-oxidanidyl-6-oxidanylidene-1H-pyrazin-4-ium-2-carboxamide Openeye Name: 5-isobutyl-3-methoxy-N-[(3-methoxyphenyl)methyl]-4-oxido-6-oxo-1H-pyrazin-4-ium-2-carboxamide CAS Name: 3-methoxy-N-[(3-methoxyphenyl)methyl]-5-(2-methylpropyl)-4-oxido-6-oxo-1H-pyrazin-4-ium-2-carboxamide IUPAC Name: 3-methoxy-N-[(3-methoxyphenyl)methyl]-5-(2-methylpropyl)-4-oxido-6-oxo-1H-pyrazin-4-ium-2-carboxamide Traditional Name: 5-isobutyl-6-keto-N-m-anisyl-3-methoxy-4-oxido-1H-pyrazin-4-ium-2-carboxamide Formula: C18H23N3O5 MolecularWeight: 361.39232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=[N+](C(=C(NC1=O)C(=O)NCC2=CC(=CC=C2)OC)OC)[O-]

Isomeric SMILES

CC(C)CC1=[N+](C(=C(NC1=O)C(=O)NCC2=CC(=CC=C2)OC)OC)[O-]

InChI

InChI=1S/C18H23N3O5/c1-11(2)8-14-16(22)20-15(18(26-4)21(14)24)17(23)19-10-12-6-5-7-13(9-12)25-3/h5-7,9,11H,8,10H2,1-4H3,(H,19,23)(H,20,22)