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

Systemtic Name: 6-ethyl-5-(4-ethynylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Openeye Name: 6-ethyl-5-(4-ethynylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid CAS Name: 6-ethyl-5-[(4-ethynylphenyl)-oxomethyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid IUPAC Name: 6-ethyl-5-(4-ethynylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Traditional Name: 6-ethyl-5-(4-ethynylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Formula: C19H17NO3 MolecularWeight: 307.34318

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2CCC(C2=C1)C(=O)O)C(=O)C3=CC=C(C=C3)C#C

Isomeric SMILES

CCC1=C(N2CCC(C2=C1)C(=O)O)C(=O)C3=CC=C(C=C3)C#C

InChI

InChI=1S/C19H17NO3/c1-3-12-5-7-14(8-6-12)18(21)17-13(4-2)11-16-15(19(22)23)9-10-20(16)17/h1,5-8,11,15H,4,9-10H2,2H3,(H,22,23)