[2-[(2-methyl-4-thiocyanato-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(1R)-cyclopent-2-en-1-yl]ethanoate

Systemtic Name: [2-[(2-methyl-4-thiocyanato-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(1R)-cyclopent-2-en-1-yl]ethanoate Openeye Name: [2-(2-methyl-4-thiocyanato-anilino)-2-oxo-ethyl] 2-[(1R)-cyclopent-2-en-1-yl]acetate CAS Name: 2-[(1R)-1-cyclopent-2-enyl]acetic acid [2-(2-methyl-4-thiocyanatoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-4-thiocyanatoanilino)-2-oxoethyl] 2-[(1R)-cyclopent-2-en-1-yl]acetate Traditional Name: 2-[(1R)-cyclopent-2-en-1-yl]acetic acid [2-keto-2-(2-methyl-4-thiocyanato-anilino)ethyl] ester Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC#N)NC(=O)COC(=O)CC2CCC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)SC#N)NC(=O)COC(=O)C[C@H]2CCC=C2

InChI

InChI=1S/C17H18N2O3S/c1-12-8-14(23-11-18)6-7-15(12)19-16(20)10-22-17(21)9-13-4-2-3-5-13/h2,4,6-8,13H,3,5,9-10H2,1H3,(H,19,20)/t13-/m1/s1