tert-butyl 9-(1-benzothiophen-2-yl)-7-phenyl-8-azaspiro[4.5]deca-6,9-diene-8-carboxylate

Systemtic Name: tert-butyl 9-(1-benzothiophen-2-yl)-7-phenyl-8-azaspiro[4.5]deca-6,9-diene-8-carboxylate Openeye Name: tert-butyl 9-(benzothiophen-2-yl)-7-phenyl-8-azaspiro[4.5]deca-6,9-diene-8-carboxylate CAS Name: 9-(1-benzothiophen-2-yl)-7-phenyl-8-azaspiro[4.5]deca-6,9-diene-8-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 9-(1-benzothiophen-2-yl)-7-phenyl-8-azaspiro[4.5]deca-6,9-diene-8-carboxylate Traditional Name: 9-(benzothiophen-2-yl)-7-phenyl-8-azaspiro[4.5]deca-6,9-diene-8-carboxylic acid tert-butyl ester Formula: C28H29NO2S MolecularWeight: 443.60036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(=CC2(CCCC2)C=C1C3=CC4=CC=CC=C4S3)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1C(=CC2(CCCC2)C=C1C3=CC4=CC=CC=C4S3)C5=CC=CC=C5

InChI

InChI=1S/C28H29NO2S/c1-27(2,3)31-26(30)29-22(20-11-5-4-6-12-20)18-28(15-9-10-16-28)19-23(29)25-17-21-13-7-8-14-24(21)32-25/h4-8,11-14,17-19H,9-10,15-16H2,1-3H3