2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[2-adamantyloxy(oxo)methyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)propionic acid Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3OC(=O)NC(CC4=CNC5=CC=CC=C54)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)C3OC(=O)NC(CC4=CNC5=CC=CC=C54)C(=O)O

InChI

InChI=1S/C22H26N2O4/c25-21(26)19(10-16-11-23-18-4-2-1-3-17(16)18)24-22(27)28-20-14-6-12-5-13(8-14)9-15(20)7-12/h1-4,11-15,19-20,23H,5-10H2,(H,24,27)(H,25,26)