4-[[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]amino]-6-chloranyl-8-pyrrolidin-1-yl-chromen-2-one

Systemtic Name: 4-[[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]amino]-6-chloranyl-8-pyrrolidin-1-yl-chromen-2-one Openeye Name: 4-[[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidyl]amino]-6-chloro-8-pyrrolidin-1-yl-chromen-2-one CAS Name: 4-[[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidinyl]amino]-6-chloro-8-(1-pyrrolidinyl)-1-benzopyran-2-one IUPAC Name: 4-[[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]amino]-6-chloro-8-pyrrolidin-1-ylchromen-2-one Traditional Name: 6-chloro-4-[(1-piperonyl-4-piperidyl)amino]-8-pyrrolidino-coumarin Formula: C26H28ClN3O4 MolecularWeight: 481.97122

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C3C(=CC(=C2)Cl)C(=CC(=O)O3)NC4CCN(CC4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CCN(C1)C2=C3C(=CC(=C2)Cl)C(=CC(=O)O3)NC4CCN(CC4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C26H28ClN3O4/c27-18-12-20-21(14-25(31)34-26(20)22(13-18)30-7-1-2-8-30)28-19-5-9-29(10-6-19)15-17-3-4-23-24(11-17)33-16-32-23/h3-4,11-14,19,28H,1-2,5-10,15-16H2