tert-butyl 3-oxidanylidene-5-[(E)-2-phenylethenyl]spiro[1-benzofuran-2,4'-piperidine]-1'-carboxylate

Systemtic Name: tert-butyl 3-oxidanylidene-5-[(E)-2-phenylethenyl]spiro[1-benzofuran-2,4'-piperidine]-1'-carboxylate Openeye Name: tert-butyl 3-oxo-5-[(E)-styryl]spiro[benzofuran-2,4'-piperidine]-1'-carboxylate CAS Name: 3-oxo-5-[(E)-2-phenylethenyl]-1'-spiro[benzofuran-2,4'-piperidine]carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-oxo-5-[(E)-2-phenylethenyl]spiro[1-benzofuran-2,4'-piperidine]-1'-carboxylate Traditional Name: 3-keto-5-[(E)-styryl]spiro[coumaran-2,4'-piperidine]-1'-carboxylic acid tert-butyl ester Formula: C25H27NO4 MolecularWeight: 405.48618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)C3=C(O2)C=CC(=C3)C=CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)C3=C(O2)C=CC(=C3)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H27NO4/c1-24(2,3)30-23(28)26-15-13-25(14-16-26)22(27)20-17-19(11-12-21(20)29-25)10-9-18-7-5-4-6-8-18/h4-12,17H,13-16H2,1-3H3/b10-9+