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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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