N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-8-methoxy-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-8-methoxy-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-8-methoxy-2-oxo-chromene-3-carboxamide CAS Name: N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-8-methoxy-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-8-methoxy-2-oxochromene-3-carboxamide Traditional Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-keto-8-methoxy-chromene-3-carboxamide Formula: C27H26N4O4 MolecularWeight: 470.51974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=O)C(=C2)C(=O)NC3=CC=CC(=C3)C4=NN=C(C=C4)N5CCCCCC5

Isomeric SMILES

COC1=CC=CC2=C1OC(=O)C(=C2)C(=O)NC3=CC=CC(=C3)C4=NN=C(C=C4)N5CCCCCC5

InChI

InChI=1S/C27H26N4O4/c1-34-23-11-7-9-19-17-21(27(33)35-25(19)23)26(32)28-20-10-6-8-18(16-20)22-12-13-24(30-29-22)31-14-4-2-3-5-15-31/h6-13,16-17H,2-5,14-15H2,1H3,(H,28,32)