3,5-ditert-butyl-1-[3-(3,5-ditert-butyl-2,7-dihydroazepin-1-yl)propyl]-2,7-dihydroazepine

Systemtic Name: 3,5-ditert-butyl-1-[3-(3,5-ditert-butyl-2,7-dihydroazepin-1-yl)propyl]-2,7-dihydroazepine Openeye Name: 3,5-ditert-butyl-1-[3-(3,5-ditert-butyl-2,7-dihydroazepin-1-yl)propyl]-2,7-dihydroazepine CAS Name: 3,5-ditert-butyl-1-[3-(3,5-ditert-butyl-2,7-dihydroazepin-1-yl)propyl]-2,7-dihydroazepine IUPAC Name: 3,5-ditert-butyl-1-[3-(3,5-ditert-butyl-2,7-dihydroazepin-1-yl)propyl]-2,7-dihydroazepine Traditional Name: 3,5-ditert-butyl-1-[3-(3,5-ditert-butyl-2,7-dihydroazepin-1-yl)propyl]-2,7-dihydroazepine Formula: C31H54N2 MolecularWeight: 454.77386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CCN(C1)CCCN2CC=C(C=C(C2)C(C)(C)C)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CCN(C1)CCCN2CC=C(C=C(C2)C(C)(C)C)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C31H54N2/c1-28(2,3)24-14-18-32(22-26(20-24)30(7,8)9)16-13-17-33-19-15-25(29(4,5)6)21-27(23-33)31(10,11)12/h14-15,20-21H,13,16-19,22-23H2,1-12H3