2-(1H-indol-3-ylmethyl)-8-[(2-methylpropan-2-yl)oxycarbonylamino]-8a-oxidanyl-3-oxidanylidene-5,6,7,8-tetrahydro-1H-indolizine-2-carboxylic acid

Systemtic Name: 2-(1H-indol-3-ylmethyl)-8-[(2-methylpropan-2-yl)oxycarbonylamino]-8a-oxidanyl-3-oxidanylidene-5,6,7,8-tetrahydro-1H-indolizine-2-carboxylic acid Openeye Name: 8-(tert-butoxycarbonylamino)-8a-hydroxy-2-(1H-indol-3-ylmethyl)-3-oxo-5,6,7,8-tetrahydro-1H-indolizine-2-carboxylic acid CAS Name: 8a-hydroxy-2-(1H-indol-3-ylmethyl)-8-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxo-5,6,7,8-tetrahydro-1H-indolizine-2-carboxylic acid IUPAC Name: 8a-hydroxy-2-(1H-indol-3-ylmethyl)-8-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-5,6,7,8-tetrahydro-1H-indolizine-2-carboxylic acid Traditional Name: 8-(tert-butoxycarbonylamino)-8a-hydroxy-2-(1H-indol-3-ylmethyl)-3-keto-indolizidine-2-carboxylic acid Formula: C23H29N3O6 MolecularWeight: 443.49286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCCN2C1(CC(C2=O)(CC3=CNC4=CC=CC=C43)C(=O)O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCCN2C1(CC(C2=O)(CC3=CNC4=CC=CC=C43)C(=O)O)O

InChI

InChI=1S/C23H29N3O6/c1-21(2,3)32-20(30)25-17-9-6-10-26-18(27)22(19(28)29,13-23(17,26)31)11-14-12-24-16-8-5-4-7-15(14)16/h4-5,7-8,12,17,24,31H,6,9-11,13H2,1-3H3,(H,25,30)(H,28,29)