7-methyl-4-[[4-[oxidanyl(phenyl)methyl]piperidin-1-yl]methyl]-6-propan-2-yl-chromen-2-one

Systemtic Name: 7-methyl-4-[[4-[oxidanyl(phenyl)methyl]piperidin-1-yl]methyl]-6-propan-2-yl-chromen-2-one Openeye Name: 4-[[4-[hydroxy(phenyl)methyl]-1-piperidyl]methyl]-6-isopropyl-7-methyl-chromen-2-one CAS Name: 4-[[4-[hydroxy(phenyl)methyl]-1-piperidinyl]methyl]-7-methyl-6-propan-2-yl-1-benzopyran-2-one IUPAC Name: 4-[[4-[hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-7-methyl-6-propan-2-ylchromen-2-one Traditional Name: 4-[[4-[hydroxy(phenyl)methyl]piperidino]methyl]-6-isopropyl-7-methyl-coumarin Formula: C26H31NO3 MolecularWeight: 405.52924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCC(CC3)C(C4=CC=CC=C4)O)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3CCC(CC3)C(C4=CC=CC=C4)O)C(C)C

InChI

InChI=1S/C26H31NO3/c1-17(2)22-15-23-21(14-25(28)30-24(23)13-18(22)3)16-27-11-9-20(10-12-27)26(29)19-7-5-4-6-8-19/h4-8,13-15,17,20,26,29H,9-12,16H2,1-3H3