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

Systemtic Name: 4-[[3,5-bis(chloranyl)pyridin-4-yl]amino]-7-methoxy-8-(3-oxidanylpropoxy)chromen-2-one Openeye Name: 4-[(3,5-dichloro-4-pyridyl)amino]-8-(3-hydroxypropoxy)-7-methoxy-chromen-2-one CAS Name: 4-[(3,5-dichloro-4-pyridinyl)amino]-8-(3-hydroxypropoxy)-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[(3,5-dichloropyridin-4-yl)amino]-8-(3-hydroxypropoxy)-7-methoxychromen-2-one Traditional Name: 4-[(3,5-dichloro-4-pyridyl)amino]-8-(3-hydroxypropoxy)-7-methoxy-coumarin Formula: C18H16Cl2N2O5 MolecularWeight: 411.23604

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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)OCCCO

Isomeric SMILES

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

InChI

InChI=1S/C18H16Cl2N2O5/c1-25-14-4-3-10-13(22-16-11(19)8-21-9-12(16)20)7-15(24)27-17(10)18(14)26-6-2-5-23/h3-4,7-9,23H,2,5-6H2,1H3,(H,21,22)