methyl 5-(2-butylpyrrol-2-yl)carbonyl-6-chloranyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate

Systemtic Name: methyl 5-(2-butylpyrrol-2-yl)carbonyl-6-chloranyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate Openeye Name: methyl 5-(2-butylpyrrole-2-carbonyl)-6-chloro-2,3-dihydro-1H-pyrrolizine-1-carboxylate CAS Name: 5-[(2-butyl-2-pyrrolyl)-oxomethyl]-6-chloro-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid methyl ester IUPAC Name: methyl 5-(2-butylpyrrole-2-carbonyl)-6-chloro-2,3-dihydro-1H-pyrrolizine-1-carboxylate Traditional Name: 5-(2-butylpyrrole-2-carbonyl)-6-chloro-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid methyl ester Formula: C18H21ClN2O3 MolecularWeight: 348.82394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C=CC=N1)C(=O)C2=C(C=C3N2CCC3C(=O)OC)Cl

Isomeric SMILES

CCCCC1(C=CC=N1)C(=O)C2=C(C=C3N2CCC3C(=O)OC)Cl

InChI

InChI=1S/C18H21ClN2O3/c1-3-4-7-18(8-5-9-20-18)16(22)15-13(19)11-14-12(17(23)24-2)6-10-21(14)15/h5,8-9,11-12H,3-4,6-7,10H2,1-2H3