4-(2-adamantyloxy)-2-azanyl-3-(1H-indol-2-yl)-2-methyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(2-adamantyloxy)-2-azanyl-3-(1H-indol-2-yl)-2-methyl-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-adamantyloxy)-2-amino-3-(1H-indol-2-yl)-2-methyl-4-oxo-butanoic acid CAS Name: 4-(2-adamantyloxy)-2-amino-3-(1H-indol-2-yl)-2-methyl-4-oxobutanoic acid IUPAC Name: 4-(2-adamantyloxy)-2-amino-3-(1H-indol-2-yl)-2-methyl-4-oxobutanoic acid Traditional Name: 4-(2-adamantyloxy)-2-amino-3-(1H-indol-2-yl)-4-keto-2-methyl-butyric acid Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC2=CC=CC=C2N1)C(=O)OC3C4CC5CC(C4)CC3C5)(C(=O)O)N

Isomeric SMILES

CC(C(C1=CC2=CC=CC=C2N1)C(=O)OC3C4CC5CC(C4)CC3C5)(C(=O)O)N

InChI

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