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

Systemtic Name: 2-(1-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methyl-propanoic acid Openeye Name: 2-(1-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methyl-propanoic acid CAS Name: 2-[[1-adamantyloxy(oxo)methyl]amino]-3-(1H-indol-3-yl)-2-methylpropanoic acid IUPAC Name: 2-(1-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methylpropanoic acid Traditional Name: 2-(1-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methyl-propionic acid Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)O)NC(=O)OC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(CC1=CNC2=CC=CC=C21)(C(=O)O)NC(=O)OC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H28N2O4/c1-22(20(26)27,12-17-13-24-19-5-3-2-4-18(17)19)25-21(28)29-23-9-14-6-15(10-23)8-16(7-14)11-23/h2-5,13-16,24H,6-12H2,1H3,(H,25,28)(H,26,27)