(2S,4S)-4-(2-adamantylamino)-1-(2,3-dihydro-1H-inden-2-yl)-N,N-diethyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S,4S)-4-(2-adamantylamino)-1-(2,3-dihydro-1H-inden-2-yl)-N,N-diethyl-pyrrolidine-2-carboxamide Openeye Name: (2S,4S)-4-(2-adamantylamino)-N,N-diethyl-1-indan-2-yl-pyrrolidine-2-carboxamide CAS Name: (2S,4S)-4-(2-adamantylamino)-1-(2,3-dihydro-1H-inden-2-yl)-N,N-diethyl-2-pyrrolidinecarboxamide IUPAC Name: (2S,4S)-4-(2-adamantylamino)-1-(2,3-dihydro-1H-inden-2-yl)-N,N-diethylpyrrolidine-2-carboxamide Traditional Name: (2S,4S)-4-(2-adamantylamino)-N,N-diethyl-1-indan-2-yl-pyrrolidine-2-carboxamide Formula: C28H41N3O MolecularWeight: 435.64464

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CC(CN1C2CC3=CC=CC=C3C2)NC4C5CC6CC(C5)CC4C6

Isomeric SMILES

CCN(CC)C(=O)[C@@H]1C[C@@H](CN1C2CC3=CC=CC=C3C2)NC4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C28H41N3O/c1-3-30(4-2)28(32)26-16-24(17-31(26)25-14-20-7-5-6-8-21(20)15-25)29-27-22-10-18-9-19(12-22)13-23(27)11-18/h5-8,18-19,22-27,29H,3-4,9-17H2,1-2H3/t18?,19?,22?,23?,24-,26-,27?/m0/s1