[3-(phenylmethyl)pyrrol-1-yl]methyl 3-[(E)-but-2-enoxy]-2,2-dimethyl-cyclopropane-1-carboxylate

Systemtic Name: [3-(phenylmethyl)pyrrol-1-yl]methyl 3-[(E)-but-2-enoxy]-2,2-dimethyl-cyclopropane-1-carboxylate Openeye Name: (3-benzylpyrrol-1-yl)methyl 3-[(E)-but-2-enoxy]-2,2-dimethyl-cyclopropanecarboxylate CAS Name: 3-[(E)-but-2-enoxy]-2,2-dimethyl-1-cyclopropanecarboxylic acid [3-(phenylmethyl)-1-pyrrolyl]methyl ester IUPAC Name: (3-benzylpyrrol-1-yl)methyl 3-[(E)-but-2-enoxy]-2,2-dimethylcyclopropane-1-carboxylate Traditional Name: 3-[(E)-but-2-enoxy]-2,2-dimethyl-cyclopropanecarboxylic acid (3-benzylpyrrol-1-yl)methyl ester Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCOC1C(C1(C)C)C(=O)OCN2C=CC(=C2)CC3=CC=CC=C3

Isomeric SMILES

C/C=C/COC1C(C1(C)C)C(=O)OCN2C=CC(=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H27NO3/c1-4-5-13-25-20-19(22(20,2)3)21(24)26-16-23-12-11-18(15-23)14-17-9-7-6-8-10-17/h4-12,15,19-20H,13-14,16H2,1-3H3/b5-4+