[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-(2,3-dihydroindol-1-ylcarbonyl)cyclohexane-1-carboxylate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-(2,3-dihydroindol-1-ylcarbonyl)cyclohexane-1-carboxylate Openeye Name: (1-allophanoyl-2-methyl-propyl) 2-(indoline-1-carbonyl)cyclohexanecarboxylate CAS Name: 2-[2,3-dihydroindol-1-yl(oxo)methyl]-1-cyclohexanecarboxylic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 2-(2,3-dihydroindole-1-carbonyl)cyclohexane-1-carboxylate Traditional Name: 2-(indoline-1-carbonyl)cyclohexanecarboxylic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C22H29N3O5 MolecularWeight: 415.48276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)C1CCCCC1C(=O)N2CCC3=CC=CC=C32

Isomeric SMILES

CC(C)C(C(=O)NC(=O)N)OC(=O)C1CCCCC1C(=O)N2CCC3=CC=CC=C32

InChI

InChI=1S/C22H29N3O5/c1-13(2)18(19(26)24-22(23)29)30-21(28)16-9-5-4-8-15(16)20(27)25-12-11-14-7-3-6-10-17(14)25/h3,6-7,10,13,15-16,18H,4-5,8-9,11-12H2,1-2H3,(H3,23,24,26,29)