tert-butyl 4-[(1R,2E)-2-(2-methoxy-2-oxidanylidene-ethylidene)cyclopentyl]indole-1-carboxylate

Systemtic Name: tert-butyl 4-[(1R,2E)-2-(2-methoxy-2-oxidanylidene-ethylidene)cyclopentyl]indole-1-carboxylate Openeye Name: tert-butyl 4-[(1R,2E)-2-(2-methoxy-2-oxo-ethylidene)cyclopentyl]indole-1-carboxylate CAS Name: 4-[(1R,2E)-2-(2-methoxy-2-oxoethylidene)cyclopentyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(1R,2E)-2-(2-methoxy-2-oxoethylidene)cyclopentyl]indole-1-carboxylate Traditional Name: 4-[(1R,2E)-2-(2-keto-2-methoxy-ethylidene)cyclopentyl]indole-1-carboxylic acid tert-butyl ester Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CC2=C(C=CC=C21)C3CCCC3=CC(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CC2=C(C=CC=C21)[C@@H]\3CCC/C3=C\C(=O)OC

InChI

InChI=1S/C21H25NO4/c1-21(2,3)26-20(24)22-12-11-17-16(9-6-10-18(17)22)15-8-5-7-14(15)13-19(23)25-4/h6,9-13,15H,5,7-8H2,1-4H3/b14-13+/t15-/m1/s1