4-[4-[5,6-bis(chloranyl)benzimidazol-1-yl]butyl-piperidin-4-yl-amino]-6-chloranyl-chromen-2-one

Systemtic Name: 4-[4-[5,6-bis(chloranyl)benzimidazol-1-yl]butyl-piperidin-4-yl-amino]-6-chloranyl-chromen-2-one Openeye Name: 6-chloro-4-[4-(5,6-dichlorobenzimidazol-1-yl)butyl-(4-piperidyl)amino]chromen-2-one CAS Name: 6-chloro-4-[4-(5,6-dichloro-1-benzimidazolyl)butyl-(4-piperidinyl)amino]-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[4-(5,6-dichlorobenzimidazol-1-yl)butyl-piperidin-4-ylamino]chromen-2-one Traditional Name: 6-chloro-4-[4-(5,6-dichlorobenzimidazol-1-yl)butyl-(4-piperidyl)amino]coumarin Formula: C25H25Cl3N4O2 MolecularWeight: 519.8506

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N(CCCCN2C=NC3=CC(=C(C=C32)Cl)Cl)C4=CC(=O)OC5=C4C=C(C=C5)Cl

Isomeric SMILES

C1CNCCC1N(CCCCN2C=NC3=CC(=C(C=C32)Cl)Cl)C4=CC(=O)OC5=C4C=C(C=C5)Cl

InChI

InChI=1S/C25H25Cl3N4O2/c26-16-3-4-24-18(11-16)22(14-25(33)34-24)32(17-5-7-29-8-6-17)10-2-1-9-31-15-30-21-12-19(27)20(28)13-23(21)31/h3-4,11-15,17,29H,1-2,5-10H2