[(2S)-2-methylbutyl] 2-azanyl-1-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: [(2S)-2-methylbutyl] 2-azanyl-1-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: [(2S)-2-methylbutyl] 2-amino-1-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-phenethyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid [(2S)-2-methylbutyl] ester IUPAC Name: [(2S)-2-methylbutyl] 2-amino-1-phenethylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid [(2S)-2-methylbutyl] ester Formula: C24H26N4O2 MolecularWeight: 402.48884

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCC4=CC=CC=C4)N

Isomeric SMILES

CC[C@H](C)COC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCC4=CC=CC=C4)N

InChI

InChI=1S/C24H26N4O2/c1-3-16(2)15-30-24(29)20-21-23(27-19-12-8-7-11-18(19)26-21)28(22(20)25)14-13-17-9-5-4-6-10-17/h4-12,16H,3,13-15,25H2,1-2H3/t16-/m0/s1