[(2R)-1-(cyclopentylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 1-ethylindole-3-carboxylate

Systemtic Name: [(2R)-1-(cyclopentylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 1-ethylindole-3-carboxylate Openeye Name: [(1R)-2-(cyclopentylcarbamoylamino)-1-methyl-2-oxo-ethyl] 1-ethylindole-3-carboxylate CAS Name: 1-ethyl-3-indolecarboxylic acid [(2R)-1-[[(cyclopentylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopentylcarbamoylamino)-1-oxopropan-2-yl] 1-ethylindole-3-carboxylate Traditional Name: 1-ethylindole-3-carboxylic acid [(1R)-2-(cyclopentylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C(=O)OC(C)C(=O)NC(=O)NC3CCCC3

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C(=O)O[C@H](C)C(=O)NC(=O)NC3CCCC3

InChI

InChI=1S/C20H25N3O4/c1-3-23-12-16(15-10-6-7-11-17(15)23)19(25)27-13(2)18(24)22-20(26)21-14-8-4-5-9-14/h6-7,10-14H,3-5,8-9H2,1-2H3,(H2,21,22,24,26)/t13-/m1/s1