2-azanyl-1-(1,3-benzodioxol-5-ylmethyl)-N-[(2R)-butan-2-yl]pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-(1,3-benzodioxol-5-ylmethyl)-N-[(2R)-butan-2-yl]pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(1,3-benzodioxol-5-ylmethyl)-N-[(1R)-1-methylpropyl]pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(1,3-benzodioxol-5-ylmethyl)-N-[(2R)-butan-2-yl]-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(1,3-benzodioxol-5-ylmethyl)-N-[(2R)-butan-2-yl]pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-[(1R)-1-methylpropyl]-1-piperonyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC5=C(C=C4)OCO5)N

Isomeric SMILES

CC[C@@H](C)NC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC5=C(C=C4)OCO5)N

InChI

InChI=1S/C23H23N5O3/c1-3-13(2)25-23(29)19-20-22(27-16-7-5-4-6-15(16)26-20)28(21(19)24)11-14-8-9-17-18(10-14)31-12-30-17/h4-10,13H,3,11-12,24H2,1-2H3,(H,25,29)/t13-/m1/s1