(2S)-5-(2-adamantyloxy)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-5-(2-adamantyloxy)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-5-(2-adamantyloxy)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxo-pentanoic acid CAS Name: (2S)-5-(2-adamantyloxy)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-5-oxopentanoic acid IUPAC Name: (2S)-5-(2-adamantyloxy)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxopentanoic acid Traditional Name: (2S)-5-(2-adamantyloxy)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-keto-valeric acid Formula: C30H33NO6 MolecularWeight: 503.58612

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3OC(=O)CCC(C(=O)O)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46

Isomeric SMILES

C1C2CC3CC1CC(C2)C3OC(=O)CC[C@@H](C(=O)O)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46

InChI

InChI=1S/C30H33NO6/c32-27(37-28-19-12-17-11-18(14-19)15-20(28)13-17)10-9-26(29(33)34)31-30(35)36-16-25-23-7-3-1-5-21(23)22-6-2-4-8-24(22)25/h1-8,17-20,25-26,28H,9-16H2,(H,31,35)(H,33,34)/t17?,18?,19?,20?,26-,28?/m0/s1