N-[[3-(aminomethyl)phenyl]methyl]-1-ethanoyl-2-(2-methylpropyl)-3-oxidanylidene-2,4-dihydroquinoxaline-6-carboxamide

Systemtic Name: N-[[3-(aminomethyl)phenyl]methyl]-1-ethanoyl-2-(2-methylpropyl)-3-oxidanylidene-2,4-dihydroquinoxaline-6-carboxamide Openeye Name: 1-acetyl-N-[[3-(aminomethyl)phenyl]methyl]-2-isobutyl-3-oxo-2,4-dihydroquinoxaline-6-carboxamide CAS Name: 1-acetyl-N-[[3-(aminomethyl)phenyl]methyl]-2-(2-methylpropyl)-3-oxo-2,4-dihydroquinoxaline-6-carboxamide IUPAC Name: 1-acetyl-N-[[3-(aminomethyl)phenyl]methyl]-2-(2-methylpropyl)-3-oxo-2,4-dihydroquinoxaline-6-carboxamide Traditional Name: 1-acetyl-N-[3-(aminomethyl)benzyl]-2-isobutyl-3-keto-2,4-dihydroquinoxaline-6-carboxamide Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)NC2=C(N1C(=O)C)C=CC(=C2)C(=O)NCC3=CC=CC(=C3)CN

Isomeric SMILES

CC(C)CC1C(=O)NC2=C(N1C(=O)C)C=CC(=C2)C(=O)NCC3=CC=CC(=C3)CN

InChI

InChI=1S/C23H28N4O3/c1-14(2)9-21-23(30)26-19-11-18(7-8-20(19)27(21)15(3)28)22(29)25-13-17-6-4-5-16(10-17)12-24/h4-8,10-11,14,21H,9,12-13,24H2,1-3H3,(H,25,29)(H,26,30)