cyclohexyl 2-azanyl-1-(1-phenylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: cyclohexyl 2-azanyl-1-(1-phenylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: cyclohexyl 2-amino-1-(1-phenylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(1-phenylethyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-amino-1-(1-phenylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(1-phenylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid cyclohexyl ester Formula: C25H26N4O2 MolecularWeight: 414.49954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)OC5CCCCC5)N

Isomeric SMILES

CC(C1=CC=CC=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)OC5CCCCC5)N

InChI

InChI=1S/C25H26N4O2/c1-16(17-10-4-2-5-11-17)29-23(26)21(25(30)31-18-12-6-3-7-13-18)22-24(29)28-20-15-9-8-14-19(20)27-22/h2,4-5,8-11,14-16,18H,3,6-7,12-13,26H2,1H3