6-[4-[[3,5-bis(chloranyl)pyridin-4-yl]amino]-7-methoxy-2-oxidanylidene-chromen-8-yl]oxyhexanenitrile

Systemtic Name: 6-[4-[[3,5-bis(chloranyl)pyridin-4-yl]amino]-7-methoxy-2-oxidanylidene-chromen-8-yl]oxyhexanenitrile Openeye Name: 6-[4-[(3,5-dichloro-4-pyridyl)amino]-7-methoxy-2-oxo-chromen-8-yl]oxyhexanenitrile CAS Name: 6-[[4-[(3,5-dichloro-4-pyridinyl)amino]-7-methoxy-2-oxo-1-benzopyran-8-yl]oxy]hexanenitrile IUPAC Name: 6-[4-[(3,5-dichloropyridin-4-yl)amino]-7-methoxy-2-oxochromen-8-yl]oxyhexanenitrile Traditional Name: 6-[4-[(3,5-dichloro-4-pyridyl)amino]-2-keto-7-methoxy-chromen-8-yl]oxyhexanenitrile Formula: C21H19Cl2N3O4 MolecularWeight: 448.29926

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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)OCCCCCC#N

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=CC(=O)O2)NC3=C(C=NC=C3Cl)Cl)OCCCCCC#N

InChI

InChI=1S/C21H19Cl2N3O4/c1-28-17-7-6-13-16(26-19-14(22)11-25-12-15(19)23)10-18(27)30-20(13)21(17)29-9-5-3-2-4-8-24/h6-7,10-12H,2-5,9H2,1H3,(H,25,26)