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

Systemtic Name: 4-[[3,5-bis(chloranyl)pyridin-4-yl]amino]-7-methoxy-8-(5-oxidanylpentoxy)chromen-2-one Openeye Name: 4-[(3,5-dichloro-4-pyridyl)amino]-8-(5-hydroxypentoxy)-7-methoxy-chromen-2-one CAS Name: 4-[(3,5-dichloro-4-pyridinyl)amino]-8-(5-hydroxypentoxy)-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[(3,5-dichloropyridin-4-yl)amino]-8-(5-hydroxypentoxy)-7-methoxychromen-2-one Traditional Name: 4-[(3,5-dichloro-4-pyridyl)amino]-8-(5-hydroxypentoxy)-7-methoxy-coumarin Formula: C20H20Cl2N2O5 MolecularWeight: 439.2892

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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)OCCCCCO

Isomeric SMILES

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

InChI

InChI=1S/C20H20Cl2N2O5/c1-27-16-6-5-12-15(24-18-13(21)10-23-11-14(18)22)9-17(26)29-19(12)20(16)28-8-4-2-3-7-25/h5-6,9-11,25H,2-4,7-8H2,1H3,(H,23,24)