4-[[[4-[(5S,7R)-3-phenyl-1-adamantyl]phenyl]amino]methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[[4-[(5S,7R)-3-phenyl-1-adamantyl]phenyl]amino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[[4-[(5S,7R)-3-phenyl-1-adamantyl]anilino]methylene]cyclohexa-2,5-dien-1-one CAS Name: 4-[[4-[(5S,7R)-3-phenyl-1-adamantyl]anilino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[4-[(5S,7R)-3-phenyl-1-adamantyl]anilino]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[[4-[(5S,7R)-3-phenyl-1-adamantyl]anilino]methylene]cyclohexa-2,5-dien-1-one Formula: C29H29NO MolecularWeight: 407.54666

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)C4=CC=C(C=C4)NC=C5C=CC(=O)C=C5)C6=CC=CC=C6

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)C4=CC=C(C=C4)NC=C5C=CC(=O)C=C5)C6=CC=CC=C6

InChI

InChI=1S/C29H29NO/c31-27-12-6-21(7-13-27)19-30-26-10-8-25(9-11-26)29-17-22-14-23(18-29)16-28(15-22,20-29)24-4-2-1-3-5-24/h1-13,19,22-23,30H,14-18,20H2/t22-,23+,28?,29?