4-[[3,5-bis(chloranyl)pyridin-4-yl]amino]-7-methoxy-8-phenylmethoxy-chromen-2-one

Systemtic Name: 4-[[3,5-bis(chloranyl)pyridin-4-yl]amino]-7-methoxy-8-phenylmethoxy-chromen-2-one Openeye Name: 8-benzyloxy-4-[(3,5-dichloro-4-pyridyl)amino]-7-methoxy-chromen-2-one CAS Name: 4-[(3,5-dichloro-4-pyridinyl)amino]-7-methoxy-8-phenylmethoxy-1-benzopyran-2-one IUPAC Name: 4-[(3,5-dichloropyridin-4-yl)amino]-7-methoxy-8-phenylmethoxychromen-2-one Traditional Name: 8-benzoxy-4-[(3,5-dichloro-4-pyridyl)amino]-7-methoxy-coumarin Formula: C22H16Cl2N2O4 MolecularWeight: 443.27944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(=CC(=O)O2)NC3=C(C=NC=C3Cl)Cl)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=CC(=O)O2)NC3=C(C=NC=C3Cl)Cl)OCC4=CC=CC=C4

InChI

InChI=1S/C22H16Cl2N2O4/c1-28-18-8-7-14-17(26-20-15(23)10-25-11-16(20)24)9-19(27)30-21(14)22(18)29-12-13-5-3-2-4-6-13/h2-11H,12H2,1H3,(H,25,26)