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

Systemtic Name: 4-[[3,5-bis(chloranyl)pyridin-4-yl]amino]-8-(4-bromanylbutoxy)-7-methoxy-chromen-2-one Openeye Name: 8-(4-bromobutoxy)-4-[(3,5-dichloro-4-pyridyl)amino]-7-methoxy-chromen-2-one CAS Name: 8-(4-bromobutoxy)-4-[(3,5-dichloro-4-pyridinyl)amino]-7-methoxy-1-benzopyran-2-one IUPAC Name: 8-(4-bromobutoxy)-4-[(3,5-dichloropyridin-4-yl)amino]-7-methoxychromen-2-one Traditional Name: 8-(4-bromobutoxy)-4-[(3,5-dichloro-4-pyridyl)amino]-7-methoxy-coumarin Formula: C19H17BrCl2N2O4 MolecularWeight: 488.15928

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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)OCCCCBr

Isomeric SMILES

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

InChI

InChI=1S/C19H17BrCl2N2O4/c1-26-15-5-4-11-14(24-17-12(21)9-23-10-13(17)22)8-16(25)28-18(11)19(15)27-7-3-2-6-20/h4-5,8-10H,2-3,6-7H2,1H3,(H,23,24)