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

Systemtic Name: 4-[[3,5-bis(chloranyl)pyridin-4-yl]amino]-7-methoxy-8-phenethyloxy-chromen-2-one Openeye Name: 4-[(3,5-dichloro-4-pyridyl)amino]-7-methoxy-8-phenethyloxy-chromen-2-one CAS Name: 4-[(3,5-dichloro-4-pyridinyl)amino]-7-methoxy-8-phenethyloxy-1-benzopyran-2-one IUPAC Name: 4-[(3,5-dichloropyridin-4-yl)amino]-7-methoxy-8-phenethyloxychromen-2-one Traditional Name: 4-[(3,5-dichloro-4-pyridyl)amino]-7-methoxy-8-phenethyloxy-coumarin Formula: C23H18Cl2N2O4 MolecularWeight: 457.30602

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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)OCCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=CC(=O)O2)NC3=C(C=NC=C3Cl)Cl)OCCC4=CC=CC=C4

InChI

InChI=1S/C23H18Cl2N2O4/c1-29-19-8-7-15-18(27-21-16(24)12-26-13-17(21)25)11-20(28)31-22(15)23(19)30-10-9-14-5-3-2-4-6-14/h2-8,11-13H,9-10H2,1H3,(H,26,27)