2,2-bis(3-phenylmethoxycyclohexa-1,3-dien-1-yl)adamantane

Systemtic Name: 2,2-bis(3-phenylmethoxycyclohexa-1,3-dien-1-yl)adamantane Openeye Name: 2,2-bis(3-benzyloxycyclohexa-1,3-dien-1-yl)adamantane CAS Name: 2,2-bis(3-phenylmethoxy-1-cyclohexa-1,3-dienyl)adamantane IUPAC Name: 2,2-bis(3-phenylmethoxycyclohexa-1,3-dien-1-yl)adamantane Traditional Name: 2,2-bis(3-benzoxycyclohexa-1,3-dien-1-yl)adamantane Formula: C36H40O2 MolecularWeight: 504.7016

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC(=C1)OCC2=CC=CC=C2)C3(C4CC5CC(C4)CC3C5)C6=CC(=CCC6)OCC7=CC=CC=C7

Isomeric SMILES

C1CC(=CC(=C1)OCC2=CC=CC=C2)C3(C4CC5CC(C4)CC3C5)C6=CC(=CCC6)OCC7=CC=CC=C7

InChI

InChI=1S/C36H40O2/c1-3-9-26(10-4-1)24-37-34-15-7-13-30(22-34)36(32-18-28-17-29(20-32)21-33(36)19-28)31-14-8-16-35(23-31)38-25-27-11-5-2-6-12-27/h1-6,9-12,15-16,22-23,28-29,32-33H,7-8,13-14,17-21,24-25H2