5-(4-butoxyphenyl)carbonyl-6-chloranyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid

Systemtic Name: 5-(4-butoxyphenyl)carbonyl-6-chloranyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Openeye Name: 5-(4-butoxybenzoyl)-6-chloro-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid CAS Name: 5-[(4-butoxyphenyl)-oxomethyl]-6-chloro-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid IUPAC Name: 5-(4-butoxybenzoyl)-6-chloro-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Traditional Name: 5-(4-butoxybenzoyl)-6-chloro-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Formula: C19H20ClNO4 MolecularWeight: 361.8194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)C2=C(C=C3N2CCC3C(=O)O)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)C2=C(C=C3N2CCC3C(=O)O)Cl

InChI

InChI=1S/C19H20ClNO4/c1-2-3-10-25-13-6-4-12(5-7-13)18(22)17-15(20)11-16-14(19(23)24)8-9-21(16)17/h4-7,11,14H,2-3,8-10H2,1H3,(H,23,24)