ethyl 2-[(4-chlorophenyl)carbonylamino]-1-cyclohexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: ethyl 2-[(4-chlorophenyl)carbonylamino]-1-cyclohexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: ethyl 2-[(4-chlorobenzoyl)amino]-1-cyclohexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-[[(4-chlorophenyl)-oxomethyl]amino]-1-cyclohexyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-chlorobenzoyl)amino]-1-cyclohexylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-[(4-chlorobenzoyl)amino]-1-cyclohexyl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid ethyl ester Formula: C26H25ClN4O3 MolecularWeight: 476.9547

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4CCCCC4)NC(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4CCCCC4)NC(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H25ClN4O3/c1-2-34-26(33)21-22-24(29-20-11-7-6-10-19(20)28-22)31(18-8-4-3-5-9-18)23(21)30-25(32)16-12-14-17(27)15-13-16/h6-7,10-15,18H,2-5,8-9H2,1H3,(H,30,32)