2-(3-methylphenoxy)ethyl 4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: 2-(3-methylphenoxy)ethyl 4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: 2-(3-methylphenoxy)ethyl 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid 2-(3-methylphenoxy)ethyl ester IUPAC Name: 2-(3-methylphenoxy)ethyl 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid 2-(3-methylphenoxy)ethyl ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCOC(=O)C2=C(C(=C(N2)C)C(=O)C)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCOC(=O)C2=C(C(=C(N2)C)C(=O)C)C

InChI

InChI=1S/C18H21NO4/c1-11-6-5-7-15(10-11)22-8-9-23-18(21)17-12(2)16(14(4)20)13(3)19-17/h5-7,10,19H,8-9H2,1-4H3