(1R,6S)-6-(2,3-dihydroindol-1-ylcarbonyl)-3,4-dimethyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6S)-6-(2,3-dihydroindol-1-ylcarbonyl)-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-(indoline-1-carbonyl)-3,4-dimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[2,3-dihydroindol-1-yl(oxo)methyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-(2,3-dihydroindole-1-carbonyl)-3,4-dimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-(indoline-1-carbonyl)-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Formula: C18H20NO3- MolecularWeight: 298.3563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)N2CCC3=CC=CC=C32)C(=O)[O-])C

Isomeric SMILES

CC1=C(C[C@H]([C@H](C1)C(=O)N2CCC3=CC=CC=C32)C(=O)[O-])C

InChI

InChI=1S/C18H21NO3/c1-11-9-14(15(18(21)22)10-12(11)2)17(20)19-8-7-13-5-3-4-6-16(13)19/h3-6,14-15H,7-10H2,1-2H3,(H,21,22)/p-1/t14-,15+/m0/s1