N-(5-bromanyl-2-piperazin-1-yl-phenyl)-2-(7-methoxy-2-oxidanylidene-chromen-4-yl)ethanamide

Systemtic Name: N-(5-bromanyl-2-piperazin-1-yl-phenyl)-2-(7-methoxy-2-oxidanylidene-chromen-4-yl)ethanamide Openeye Name: N-(5-bromo-2-piperazin-1-yl-phenyl)-2-(7-methoxy-2-oxo-chromen-4-yl)acetamide CAS Name: N-[5-bromo-2-(1-piperazinyl)phenyl]-2-(7-methoxy-2-oxo-1-benzopyran-4-yl)acetamide IUPAC Name: N-(5-bromo-2-piperazin-1-ylphenyl)-2-(7-methoxy-2-oxochromen-4-yl)acetamide Traditional Name: N-(5-bromo-2-piperazino-phenyl)-2-(2-keto-7-methoxy-chromen-4-yl)acetamide Formula: C22H22BrN3O4 MolecularWeight: 472.33178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)NC3=C(C=CC(=C3)Br)N4CCNCC4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)NC3=C(C=CC(=C3)Br)N4CCNCC4

InChI

InChI=1S/C22H22BrN3O4/c1-29-16-3-4-17-14(11-22(28)30-20(17)13-16)10-21(27)25-18-12-15(23)2-5-19(18)26-8-6-24-7-9-26/h2-5,11-13,24H,6-10H2,1H3,(H,25,27)