5-(7-methoxy-2,2-dimethyl-3H-1-benzofuran-4-yl)-2-[1-(2-methoxyphenyl)carbonylpiperidin-4-yl]-4,4-dimethyl-pyrazol-3-one

Systemtic Name: 5-(7-methoxy-2,2-dimethyl-3H-1-benzofuran-4-yl)-2-[1-(2-methoxyphenyl)carbonylpiperidin-4-yl]-4,4-dimethyl-pyrazol-3-one Openeye Name: 2-[1-(2-methoxybenzoyl)-4-piperidyl]-5-(7-methoxy-2,2-dimethyl-3H-benzofuran-4-yl)-4,4-dimethyl-pyrazol-3-one CAS Name: 5-(7-methoxy-2,2-dimethyl-3H-benzofuran-4-yl)-2-[1-[(2-methoxyphenyl)-oxomethyl]-4-piperidinyl]-4,4-dimethyl-3-pyrazolone IUPAC Name: 2-[1-(2-methoxybenzoyl)piperidin-4-yl]-5-(7-methoxy-2,2-dimethyl-3H-1-benzofuran-4-yl)-4,4-dimethylpyrazol-3-one Traditional Name: 5-(7-methoxy-2,2-dimethyl-coumaran-4-yl)-4,4-dimethyl-2-(1-o-anisoyl-4-piperidyl)-2-pyrazolin-3-one Formula: C29H35N3O5 MolecularWeight: 505.6053

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC(=C2O1)OC)C3=NN(C(=O)C3(C)C)C4CCN(CC4)C(=O)C5=CC=CC=C5OC)C

Isomeric SMILES

CC1(CC2=C(C=CC(=C2O1)OC)C3=NN(C(=O)C3(C)C)C4CCN(CC4)C(=O)C5=CC=CC=C5OC)C

InChI

InChI=1S/C29H35N3O5/c1-28(2)17-21-19(11-12-23(36-6)24(21)37-28)25-29(3,4)27(34)32(30-25)18-13-15-31(16-14-18)26(33)20-9-7-8-10-22(20)35-5/h7-12,18H,13-17H2,1-6H3