methyl 2-azanyl-1-(6-methylheptan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: methyl 2-azanyl-1-(6-methylheptan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: methyl 2-amino-1-(1,5-dimethylhexyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(6-methylheptan-2-yl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid methyl ester IUPAC Name: methyl 2-amino-1-(6-methylheptan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(1,5-dimethylhexyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid methyl ester Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)N1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OC)N

Isomeric SMILES

CC(C)CCCC(C)N1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OC)N

InChI

InChI=1S/C20H26N4O2/c1-12(2)8-7-9-13(3)24-18(21)16(20(25)26-4)17-19(24)23-15-11-6-5-10-14(15)22-17/h5-6,10-13H,7-9,21H2,1-4H3