1'-(1,5-dimethylpyrazol-3-yl)carbonyl-8-methyl-7-phenylmethoxy-spiro[3H-chromene-2,4'-piperidine]-4-one

Systemtic Name: 1'-(1,5-dimethylpyrazol-3-yl)carbonyl-8-methyl-7-phenylmethoxy-spiro[3H-chromene-2,4'-piperidine]-4-one Openeye Name: 7-benzyloxy-1'-(1,5-dimethylpyrazole-3-carbonyl)-8-methyl-spiro[chromane-2,4'-piperidine]-4-one CAS Name: 1'-[(1,5-dimethyl-3-pyrazolyl)-oxomethyl]-8-methyl-7-phenylmethoxy-4-spiro[3,4-dihydro-2H-1-benzopyran-2,4'-piperidine]one IUPAC Name: 1'-(1,5-dimethylpyrazole-3-carbonyl)-8-methyl-7-phenylmethoxyspiro[3H-chromene-2,4'-piperidine]-4-one Traditional Name: 7-benzoxy-1'-(1,5-dimethylpyrazole-3-carbonyl)-8-methyl-spiro[chroman-2,4'-piperidine]-4-one Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)N2CCC3(CC2)CC(=O)C4=C(O3)C(=C(C=C4)OCC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=NN1C)C(=O)N2CCC3(CC2)CC(=O)C4=C(O3)C(=C(C=C4)OCC5=CC=CC=C5)C

InChI

InChI=1S/C27H29N3O4/c1-18-15-22(28-29(18)3)26(32)30-13-11-27(12-14-30)16-23(31)21-9-10-24(19(2)25(21)34-27)33-17-20-7-5-4-6-8-20/h4-10,15H,11-14,16-17H2,1-3H3