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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C(=O)NC2=C(N1C(=O)C)C=CC(=C2)C(=O)NCC3=CC=CC(=C3)CN

Isomeric SMILES

CCC(C)C1C(=O)NC2=C(N1C(=O)C)C=CC(=C2)C(=O)NCC3=CC=CC(=C3)CN

InChI

InChI=1S/C23H28N4O3/c1-4-14(2)21-23(30)26-19-11-18(8-9-20(19)27(21)15(3)28)22(29)25-13-17-7-5-6-16(10-17)12-24/h5-11,14,21H,4,12-13,24H2,1-3H3,(H,25,29)(H,26,30)