2-(3-methyl-4-propan-2-yl-phenoxy)ethyl 4-chloranyl-1H-pyrrole-2-carboxylate

Systemtic Name: 2-(3-methyl-4-propan-2-yl-phenoxy)ethyl 4-chloranyl-1H-pyrrole-2-carboxylate Openeye Name: 2-(4-isopropyl-3-methyl-phenoxy)ethyl 4-chloro-1H-pyrrole-2-carboxylate CAS Name: 4-chloro-1H-pyrrole-2-carboxylic acid 2-(3-methyl-4-propan-2-ylphenoxy)ethyl ester IUPAC Name: 2-(3-methyl-4-propan-2-ylphenoxy)ethyl 4-chloro-1H-pyrrole-2-carboxylate Traditional Name: 4-chloro-1H-pyrrole-2-carboxylic acid 2-(4-isopropyl-3-methyl-phenoxy)ethyl ester Formula: C17H20ClNO3 MolecularWeight: 321.7986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCOC(=O)C2=CC(=CN2)Cl)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCOC(=O)C2=CC(=CN2)Cl)C(C)C

InChI

InChI=1S/C17H20ClNO3/c1-11(2)15-5-4-14(8-12(15)3)21-6-7-22-17(20)16-9-13(18)10-19-16/h4-5,8-11,19H,6-7H2,1-3H3