3,4-dimethyl-7-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethoxy]chromen-2-one

Systemtic Name: 3,4-dimethyl-7-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethoxy]chromen-2-one Openeye Name: 7-[2-(4-benzyl-1-piperidyl)-2-oxo-ethoxy]-3,4-dimethyl-chromen-2-one CAS Name: 3,4-dimethyl-7-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethoxy]-1-benzopyran-2-one IUPAC Name: 7-[2-(4-benzylpiperidin-1-yl)-2-oxoethoxy]-3,4-dimethylchromen-2-one Traditional Name: 7-[2-(4-benzylpiperidino)-2-keto-ethoxy]-3,4-dimethyl-coumarin Formula: C25H27NO4 MolecularWeight: 405.48618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)N3CCC(CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)N3CCC(CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C25H27NO4/c1-17-18(2)25(28)30-23-15-21(8-9-22(17)23)29-16-24(27)26-12-10-20(11-13-26)14-19-6-4-3-5-7-19/h3-9,15,20H,10-14,16H2,1-2H3