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

Systemtic Name: methyl 6-butyl-5-(4-ethenylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate Openeye Name: methyl 6-butyl-5-(4-vinylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate CAS Name: 6-butyl-5-[(4-ethenylphenyl)-oxomethyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid methyl ester IUPAC Name: methyl 6-butyl-5-(4-ethenylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate Traditional Name: 6-butyl-5-(4-vinylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid methyl ester Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N2CCC(C2=C1)C(=O)OC)C(=O)C3=CC=C(C=C3)C=C

Isomeric SMILES

CCCCC1=C(N2CCC(C2=C1)C(=O)OC)C(=O)C3=CC=C(C=C3)C=C

InChI

InChI=1S/C22H25NO3/c1-4-6-7-17-14-19-18(22(25)26-3)12-13-23(19)20(17)21(24)16-10-8-15(5-2)9-11-16/h5,8-11,14,18H,2,4,6-7,12-13H2,1,3H3