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

Systemtic Name: pentyl 2-[(2-chlorophenyl)carbonylamino]-1-pentyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: pentyl 2-[(2-chlorobenzoyl)amino]-1-pentyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-[[(2-chlorophenyl)-oxomethyl]amino]-1-pentyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid pentyl ester IUPAC Name: pentyl 2-[(2-chlorobenzoyl)amino]-1-pentylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 1-amyl-2-[(2-chlorobenzoyl)amino]pyrrolo[3,2-b]quinoxaline-3-carboxylic acid amyl ester Formula: C28H31ClN4O3 MolecularWeight: 507.02374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCCCCC)NC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCCCCC)NC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C28H31ClN4O3/c1-3-5-11-17-33-25(32-27(34)19-13-7-8-14-20(19)29)23(28(35)36-18-12-6-4-2)24-26(33)31-22-16-10-9-15-21(22)30-24/h7-10,13-16H,3-6,11-12,17-18H2,1-2H3,(H,32,34)