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

Systemtic Name: 5-(4-ethynylphenyl)carbonyl-6-methyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Openeye Name: 5-(4-ethynylbenzoyl)-6-methyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid CAS Name: 5-[(4-ethynylphenyl)-oxomethyl]-6-methyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid IUPAC Name: 5-(4-ethynylbenzoyl)-6-methyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Traditional Name: 5-(4-ethynylbenzoyl)-6-methyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Formula: C18H15NO3 MolecularWeight: 293.3166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2CCC(C2=C1)C(=O)O)C(=O)C3=CC=C(C=C3)C#C

Isomeric SMILES

CC1=C(N2CCC(C2=C1)C(=O)O)C(=O)C3=CC=C(C=C3)C#C

InChI

InChI=1S/C18H15NO3/c1-3-12-4-6-13(7-5-12)17(20)16-11(2)10-15-14(18(21)22)8-9-19(15)16/h1,4-7,10,14H,8-9H2,2H3,(H,21,22)