4-[[3,5-bis(chloranyl)pyridin-4-yl]amino]-7-methoxy-8-(5-piperidin-1-ylpentoxy)chromen-2-one

Systemtic Name: 4-[[3,5-bis(chloranyl)pyridin-4-yl]amino]-7-methoxy-8-(5-piperidin-1-ylpentoxy)chromen-2-one Openeye Name: 4-[(3,5-dichloro-4-pyridyl)amino]-7-methoxy-8-[5-(1-piperidyl)pentoxy]chromen-2-one CAS Name: 4-[(3,5-dichloro-4-pyridinyl)amino]-7-methoxy-8-[5-(1-piperidinyl)pentoxy]-1-benzopyran-2-one IUPAC Name: 4-[(3,5-dichloropyridin-4-yl)amino]-7-methoxy-8-(5-piperidin-1-ylpentoxy)chromen-2-one Traditional Name: 4-[(3,5-dichloro-4-pyridyl)amino]-7-methoxy-8-(5-piperidinopentoxy)coumarin Formula: C25H29Cl2N3O4 MolecularWeight: 506.42146

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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)OCCCCCN4CCCCC4

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=CC(=O)O2)NC3=C(C=NC=C3Cl)Cl)OCCCCCN4CCCCC4

InChI

InChI=1S/C25H29Cl2N3O4/c1-32-21-9-8-17-20(29-23-18(26)15-28-16-19(23)27)14-22(31)34-24(17)25(21)33-13-7-3-6-12-30-10-4-2-5-11-30/h8-9,14-16H,2-7,10-13H2,1H3,(H,28,29)