N-[(3S,5R)-3,5-bis[(triphenylmethyl)amino]cyclohexyl]propanamide

Systemtic Name: N-[(3S,5R)-3,5-bis[(triphenylmethyl)amino]cyclohexyl]propanamide Openeye Name: N-[(3S,5R)-3,5-bis(tritylamino)cyclohexyl]propanamide CAS Name: N-[(3S,5R)-3,5-bis[(triphenylmethyl)amino]cyclohexyl]propanamide IUPAC Name: N-[(3S,5R)-3,5-bis(tritylamino)cyclohexyl]propanamide Traditional Name: N-[(3S,5R)-3,5-bis(tritylamino)cyclohexyl]propionamide Formula: C47H47N3O MolecularWeight: 669.89558

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1CC(CC(C1)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)NC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

CCC(=O)NC1C[C@@H](C[C@@H](C1)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)NC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C47H47N3O/c1-2-45(51)48-42-33-43(49-46(36-21-9-3-10-22-36,37-23-11-4-12-24-37)38-25-13-5-14-26-38)35-44(34-42)50-47(39-27-15-6-16-28-39,40-29-17-7-18-30-40)41-31-19-8-20-32-41/h3-32,42-44,49-50H,2,33-35H2,1H3,(H,48,51)/t42?,43-,44+