[(1S,4R)-4-[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]cyclopent-2-en-1-yl] N-propylcarbamate

Systemtic Name: [(1S,4R)-4-[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]cyclopent-2-en-1-yl] N-propylcarbamate Openeye Name: [(1S,4R)-4-[3,5-dimethyl-1-(o-tolyl)pyrazol-4-yl]cyclopent-2-en-1-yl] N-propylcarbamate CAS Name: N-propylcarbamic acid [(1S,4R)-4-[3,5-dimethyl-1-(2-methylphenyl)-4-pyrazolyl]-1-cyclopent-2-enyl] ester IUPAC Name: [(1S,4R)-4-[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]cyclopent-2-en-1-yl] N-propylcarbamate Traditional Name: N-propylcarbamic acid [(1S,4R)-4-[3,5-dimethyl-1-(o-tolyl)pyrazol-4-yl]cyclopent-2-en-1-yl] ester Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)OC1CC(C=C1)C2=C(N(N=C2C)C3=CC=CC=C3C)C

Isomeric SMILES

CCCNC(=O)O[C@H]1C[C@H](C=C1)C2=C(N(N=C2C)C3=CC=CC=C3C)C

InChI

InChI=1S/C21H27N3O2/c1-5-12-22-21(25)26-18-11-10-17(13-18)20-15(3)23-24(16(20)4)19-9-7-6-8-14(19)2/h6-11,17-18H,5,12-13H2,1-4H3,(H,22,25)/t17-,18+/m0/s1