N-(5-bromanyl-2-piperazin-1-yl-phenyl)-8-methoxy-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-(5-bromanyl-2-piperazin-1-yl-phenyl)-8-methoxy-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-(5-bromo-2-piperazin-1-yl-phenyl)-8-methoxy-2-oxo-chromene-3-carboxamide CAS Name: N-[5-bromo-2-(1-piperazinyl)phenyl]-8-methoxy-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-(5-bromo-2-piperazin-1-ylphenyl)-8-methoxy-2-oxochromene-3-carboxamide Traditional Name: N-(5-bromo-2-piperazino-phenyl)-2-keto-8-methoxy-chromene-3-carboxamide Formula: C21H20BrN3O4 MolecularWeight: 458.3052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=O)C(=C2)C(=O)NC3=C(C=CC(=C3)Br)N4CCNCC4

Isomeric SMILES

COC1=CC=CC2=C1OC(=O)C(=C2)C(=O)NC3=C(C=CC(=C3)Br)N4CCNCC4

InChI

InChI=1S/C21H20BrN3O4/c1-28-18-4-2-3-13-11-15(21(27)29-19(13)18)20(26)24-16-12-14(22)5-6-17(16)25-9-7-23-8-10-25/h2-6,11-12,23H,7-10H2,1H3,(H,24,26)