N-(2-adamantyl)-4-[(1R,2S)-2-azanyl-1,2-diphenyl-ethyl]piperazine-1-carboxamide

Systemtic Name: N-(2-adamantyl)-4-[(1R,2S)-2-azanyl-1,2-diphenyl-ethyl]piperazine-1-carboxamide Openeye Name: N-(2-adamantyl)-4-[(1R,2S)-2-amino-1,2-diphenyl-ethyl]piperazine-1-carboxamide CAS Name: N-(2-adamantyl)-4-[(1R,2S)-2-amino-1,2-diphenylethyl]-1-piperazinecarboxamide IUPAC Name: N-(2-adamantyl)-4-[(1R,2S)-2-amino-1,2-diphenylethyl]piperazine-1-carboxamide Traditional Name: N-(2-adamantyl)-4-[(1R,2S)-2-amino-1,2-diphenyl-ethyl]piperazine-1-carboxamide Formula: C29H38N4O MolecularWeight: 458.63822

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C(C3=CC=CC=C3)N)C(=O)NC4C5CC6CC(C5)CC4C6

Isomeric SMILES

C1CN(CCN1[C@H](C2=CC=CC=C2)[C@H](C3=CC=CC=C3)N)C(=O)NC4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C29H38N4O/c30-26(22-7-3-1-4-8-22)28(23-9-5-2-6-10-23)32-11-13-33(14-12-32)29(34)31-27-24-16-20-15-21(18-24)19-25(27)17-20/h1-10,20-21,24-28H,11-19,30H2,(H,31,34)/t20?,21?,24?,25?,26-,27?,28+/m0/s1