2-adamantyl-[3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-[(1-oxidanyl-3-phenyl-propan-2-yl)amino]propan-2-yl]carbamic acid

Systemtic Name: 2-adamantyl-[3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-[(1-oxidanyl-3-phenyl-propan-2-yl)amino]propan-2-yl]carbamic acid Openeye Name: 2-adamantyl-[2-[(1-benzyl-2-hydroxy-ethyl)amino]-1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-ethyl]carbamic acid CAS Name: 2-adamantyl-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-3-(1H-indol-3-yl)-2-methyl-1-oxopropan-2-yl]carbamic acid IUPAC Name: 2-adamantyl-[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-3-(1H-indol-3-yl)-2-methyl-1-oxopropan-2-yl]carbamic acid Traditional Name: 2-adamantyl-[2-[(1-benzyl-2-hydroxy-ethyl)amino]-1-(1H-indol-3-ylmethyl)-2-keto-1-methyl-ethyl]carbamic acid Formula: C32H39N3O4 MolecularWeight: 529.66976

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)NC(CC3=CC=CC=C3)CO)N(C4C5CC6CC(C5)CC4C6)C(=O)O

Isomeric SMILES

CC(CC1=CNC2=CC=CC=C21)(C(=O)NC(CC3=CC=CC=C3)CO)N(C4C5CC6CC(C5)CC4C6)C(=O)O

InChI

InChI=1S/C32H39N3O4/c1-32(17-25-18-33-28-10-6-5-9-27(25)28,30(37)34-26(19-36)16-20-7-3-2-4-8-20)35(31(38)39)29-23-12-21-11-22(14-23)15-24(29)13-21/h2-10,18,21-24,26,29,33,36H,11-17,19H2,1H3,(H,34,37)(H,38,39)