2-[(2-chlorophenyl)carbonylamino]-N-hexyl-1-(phenylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-[(2-chlorophenyl)carbonylamino]-N-hexyl-1-(phenylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 1-benzyl-2-[(2-chlorobenzoyl)amino]-N-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-[[(2-chlorophenyl)-oxomethyl]amino]-N-hexyl-1-(phenylmethyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 1-benzyl-2-[(2-chlorobenzoyl)amino]-N-hexylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 1-benzyl-2-[(2-chlorobenzoyl)amino]-N-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C31H30ClN5O2 MolecularWeight: 540.0552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC=CC=C4)NC(=O)C5=CC=CC=C5Cl

Isomeric SMILES

CCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC=CC=C4)NC(=O)C5=CC=CC=C5Cl

InChI

InChI=1S/C31H30ClN5O2/c1-2-3-4-12-19-33-31(39)26-27-29(35-25-18-11-10-17-24(25)34-27)37(20-21-13-6-5-7-14-21)28(26)36-30(38)22-15-8-9-16-23(22)32/h5-11,13-18H,2-4,12,19-20H2,1H3,(H,33,39)(H,36,38)