[1-azanyl-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-propan-2-yl] N-[1,3-bis(oxidanyl)-1-phenyl-propan-2-yl]carbamate

Systemtic Name: [1-azanyl-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-propan-2-yl] N-[1,3-bis(oxidanyl)-1-phenyl-propan-2-yl]carbamate Openeye Name: [2-amino-1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-ethyl] N-[2-hydroxy-1-(hydroxymethyl)-2-phenyl-ethyl]carbamate CAS Name: N-(1,3-dihydroxy-1-phenylpropan-2-yl)carbamic acid [1-amino-3-(1H-indol-3-yl)-2-methyl-1-oxopropan-2-yl] ester IUPAC Name: [1-amino-3-(1H-indol-3-yl)-2-methyl-1-oxopropan-2-yl] N-(1,3-dihydroxy-1-phenylpropan-2-yl)carbamate Traditional Name: N-(2-hydroxy-1-methylol-2-phenyl-ethyl)carbamic acid [2-amino-1-(1H-indol-3-ylmethyl)-2-keto-1-methyl-ethyl] ester Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)N)OC(=O)NC(CO)C(C3=CC=CC=C3)O

Isomeric SMILES

CC(CC1=CNC2=CC=CC=C21)(C(=O)N)OC(=O)NC(CO)C(C3=CC=CC=C3)O

InChI

InChI=1S/C22H25N3O5/c1-22(20(23)28,11-15-12-24-17-10-6-5-9-16(15)17)30-21(29)25-18(13-26)19(27)14-7-3-2-4-8-14/h2-10,12,18-19,24,26-27H,11,13H2,1H3,(H2,23,28)(H,25,29)