6-chloranyl-4-[[1-(isoquinolin-6-ylmethyl)piperidin-4-yl]amino]chromen-2-one

Systemtic Name: 6-chloranyl-4-[[1-(isoquinolin-6-ylmethyl)piperidin-4-yl]amino]chromen-2-one Openeye Name: 6-chloro-4-[[1-(6-isoquinolylmethyl)-4-piperidyl]amino]chromen-2-one CAS Name: 6-chloro-4-[[1-(6-isoquinolinylmethyl)-4-piperidinyl]amino]-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[[1-(isoquinolin-6-ylmethyl)piperidin-4-yl]amino]chromen-2-one Traditional Name: 6-chloro-4-[[1-(6-isoquinolylmethyl)-4-piperidyl]amino]coumarin Formula: C24H22ClN3O2 MolecularWeight: 419.90338

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=CC(=O)OC3=C2C=C(C=C3)Cl)CC4=CC5=C(C=C4)C=NC=C5

Isomeric SMILES

C1CN(CCC1NC2=CC(=O)OC3=C2C=C(C=C3)Cl)CC4=CC5=C(C=C4)C=NC=C5

InChI

InChI=1S/C24H22ClN3O2/c25-19-3-4-23-21(12-19)22(13-24(29)30-23)27-20-6-9-28(10-7-20)15-16-1-2-18-14-26-8-5-17(18)11-16/h1-5,8,11-14,20,27H,6-7,9-10,15H2