pentyl 2-[(2-chlorophenyl)carbonylamino]-1-cyclohexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: pentyl 2-[(2-chlorophenyl)carbonylamino]-1-cyclohexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: pentyl 2-[(2-chlorobenzoyl)amino]-1-cyclohexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-[[(2-chlorophenyl)-oxomethyl]amino]-1-cyclohexyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid pentyl ester IUPAC Name: pentyl 2-[(2-chlorobenzoyl)amino]-1-cyclohexylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-[(2-chlorobenzoyl)amino]-1-cyclohexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid amyl ester Formula: C29H31ClN4O3 MolecularWeight: 519.03444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4CCCCC4)NC(=O)C5=CC=CC=C5Cl

Isomeric SMILES

CCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4CCCCC4)NC(=O)C5=CC=CC=C5Cl

InChI

InChI=1S/C29H31ClN4O3/c1-2-3-11-18-37-29(36)24-25-27(32-23-17-10-9-16-22(23)31-25)34(19-12-5-4-6-13-19)26(24)33-28(35)20-14-7-8-15-21(20)30/h7-10,14-17,19H,2-6,11-13,18H2,1H3,(H,33,35)