(1S,2S)-N-tert-butyl-2-[4-(diphenylmethyl)piperazin-1-yl]carbonyl-cyclopropane-1-carboxamide

Systemtic Name: (1S,2S)-N-tert-butyl-2-[4-(diphenylmethyl)piperazin-1-yl]carbonyl-cyclopropane-1-carboxamide Openeye Name: (1S,2S)-2-(4-benzhydrylpiperazine-1-carbonyl)-N-tert-butyl-cyclopropanecarboxamide CAS Name: (1S,2S)-N-tert-butyl-2-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]-1-cyclopropanecarboxamide IUPAC Name: (1S,2S)-2-(4-benzhydrylpiperazine-1-carbonyl)-N-tert-butylcyclopropane-1-carboxamide Traditional Name: (1S,2S)-2-(4-benzhydrylpiperazine-1-carbonyl)-N-tert-butyl-cyclopropanecarboxamide Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1CC1C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)NC(=O)[C@H]1C[C@@H]1C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H33N3O2/c1-26(2,3)27-24(30)21-18-22(21)25(31)29-16-14-28(15-17-29)23(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,21-23H,14-18H2,1-3H3,(H,27,30)/t21-,22-/m0/s1