[1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 4-chloranyl-1H-pyrrole-2-carboxylate

Systemtic Name: [1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 4-chloranyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(cyclohexylmethylamino)-1-methyl-2-oxo-ethyl] 4-chloro-1H-pyrrole-2-carboxylate CAS Name: 4-chloro-1H-pyrrole-2-carboxylic acid [1-(cyclohexylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclohexylmethylamino)-1-oxopropan-2-yl] 4-chloro-1H-pyrrole-2-carboxylate Traditional Name: 4-chloro-1H-pyrrole-2-carboxylic acid [2-(cyclohexylmethylamino)-2-keto-1-methyl-ethyl] ester Formula: C15H21ClN2O3 MolecularWeight: 312.79184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCCCC1)OC(=O)C2=CC(=CN2)Cl

Isomeric SMILES

CC(C(=O)NCC1CCCCC1)OC(=O)C2=CC(=CN2)Cl

InChI

InChI=1S/C15H21ClN2O3/c1-10(21-15(20)13-7-12(16)9-17-13)14(19)18-8-11-5-3-2-4-6-11/h7,9-11,17H,2-6,8H2,1H3,(H,18,19)