2-tert-butyl-N-(2,6-dimethylphenyl)-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxamide

Systemtic Name: 2-tert-butyl-N-(2,6-dimethylphenyl)-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxamide Openeye Name: 2-tert-butyl-N-(2,6-dimethylphenyl)-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxamide CAS Name: 2-tert-butyl-N-(2,6-dimethylphenyl)-6,11-dihydrobenzo[c][1]benzoxepin-11-carboxamide IUPAC Name: 2-tert-butyl-N-(2,6-dimethylphenyl)-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxamide Traditional Name: 2-tert-butyl-N-(2,6-dimethylphenyl)-6,11-dihydrobenzo[c][1]benzoxepin-11-carboxamide Formula: C27H29NO2 MolecularWeight: 399.52466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C2C3=CC=CC=C3COC4=C2C=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C2C3=CC=CC=C3COC4=C2C=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H29NO2/c1-17-9-8-10-18(2)25(17)28-26(29)24-21-12-7-6-11-19(21)16-30-23-14-13-20(15-22(23)24)27(3,4)5/h6-15,24H,16H2,1-5H3,(H,28,29)