[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (2E)-2-(5-methoxy-2-oxidanylidene-1H-indol-3-ylidene)ethanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (2E)-2-(5-methoxy-2-oxidanylidene-1H-indol-3-ylidene)ethanoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] (2E)-2-(5-methoxy-2-oxo-indolin-3-ylidene)acetate CAS Name: (2E)-2-(5-methoxy-2-oxo-1H-indol-3-ylidene)acetic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (2E)-2-(5-methoxy-2-oxo-1H-indol-3-ylidene)acetate Traditional Name: (2E)-2-(2-keto-5-methoxy-indolin-3-ylidene)acetic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C=C2C3=C(C=CC(=C3)OC)NC2=O)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)/C=C/2\C3=C(C=CC(=C3)OC)NC2=O)C(C)C

InChI

InChI=1S/C21H27NO4/c1-12(2)15-7-5-13(3)9-19(15)26-20(23)11-17-16-10-14(25-4)6-8-18(16)22-21(17)24/h6,8,10-13,15,19H,5,7,9H2,1-4H3,(H,22,24)/b17-11+/t13-,15+,19-/m1/s1