N-[7-bromanyl-3-oxidanylidene-4-[(2-pyridin-3-ylpiperidin-1-yl)methyl]quinoxalin-2-yl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[7-bromanyl-3-oxidanylidene-4-[(2-pyridin-3-ylpiperidin-1-yl)methyl]quinoxalin-2-yl]-3,4-dimethoxy-benzamide Openeye Name: N-[7-bromo-3-oxo-4-[[2-(3-pyridyl)-1-piperidyl]methyl]quinoxalin-2-yl]-3,4-dimethoxy-benzamide CAS Name: N-[7-bromo-3-oxo-4-[[2-(3-pyridinyl)-1-piperidinyl]methyl]-2-quinoxalinyl]-3,4-dimethoxybenzamide IUPAC Name: N-[7-bromo-3-oxo-4-[(2-pyridin-3-ylpiperidin-1-yl)methyl]quinoxalin-2-yl]-3,4-dimethoxybenzamide Traditional Name: N-[7-bromo-3-keto-4-[[2-(3-pyridyl)piperidino]methyl]quinoxalin-2-yl]-3,4-dimethoxy-benzamide Formula: C28H28BrN5O4 MolecularWeight: 578.45702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=NC3=C(C=CC(=C3)Br)N(C2=O)CN4CCCCC4C5=CN=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=NC3=C(C=CC(=C3)Br)N(C2=O)CN4CCCCC4C5=CN=CC=C5)OC

InChI

InChI=1S/C28H28BrN5O4/c1-37-24-11-8-18(14-25(24)38-2)27(35)32-26-28(36)34(23-10-9-20(29)15-21(23)31-26)17-33-13-4-3-7-22(33)19-6-5-12-30-16-19/h5-6,8-12,14-16,22H,3-4,7,13,17H2,1-2H3,(H,31,32,35)