[1-azanyl-3-(1H-indol-3-yl)-2-methyl-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-propan-2-yl] N-[1,3-bis(oxidanyl)-1-phenyl-propan-2-yl]carbamate Openeye Name: [1-(aminomethyl)-2-(1H-indol-3-yl)-1-methyl-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-methylpropan-2-yl] ester IUPAC Name: [1-amino-3-(1H-indol-3-yl)-2-methylpropan-2-yl] N-(1,3-dihydroxy-1-phenylpropan-2-yl)carbamate Traditional Name: N-(2-hydroxy-1-methylol-2-phenyl-ethyl)carbamic acid [1-(aminomethyl)-2-(1H-indol-3-yl)-1-methyl-ethyl] ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4/c1-22(14-23,11-16-12-24-18-10-6-5-9-17(16)18)29-21(28)25-19(13-26)20(27)15-7-3-2-4-8-15/h2-10,12,19-20,24,26-27H,11,13-14,23H2,1H3,(H,25,28)