octyl 2-azanyl-1-(phenylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: octyl 2-azanyl-1-(phenylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: octyl 2-amino-1-benzyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(phenylmethyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid octyl ester IUPAC Name: octyl 2-amino-1-benzylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-benzyl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid octyl ester Formula: C26H30N4O2 MolecularWeight: 430.542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC=CC=C4)N

Isomeric SMILES

CCCCCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC=CC=C4)N

InChI

InChI=1S/C26H30N4O2/c1-2-3-4-5-6-12-17-32-26(31)22-23-25(29-21-16-11-10-15-20(21)28-23)30(24(22)27)18-19-13-8-7-9-14-19/h7-11,13-16H,2-6,12,17-18,27H2,1H3