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

Systemtic Name: pentyl 6-butyl-5-(4-ethenylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate Openeye Name: pentyl 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 pentyl ester IUPAC Name: pentyl 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 amyl ester Formula: C26H33NO3 MolecularWeight: 407.54512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1CCN2C1=CC(=C2C(=O)C3=CC=C(C=C3)C=C)CCCC

Isomeric SMILES

CCCCCOC(=O)C1CCN2C1=CC(=C2C(=O)C3=CC=C(C=C3)C=C)CCCC

InChI

InChI=1S/C26H33NO3/c1-4-7-9-17-30-26(29)22-15-16-27-23(22)18-21(10-8-5-2)24(27)25(28)20-13-11-19(6-3)12-14-20/h6,11-14,18,22H,3-5,7-10,15-17H2,1-2H3