dodecyl 7-bromanyl-5-(phenylcarbonyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate

Systemtic Name: dodecyl 7-bromanyl-5-(phenylcarbonyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate Openeye Name: dodecyl 5-benzoyl-7-bromo-2,3-dihydro-1H-pyrrolizine-1-carboxylate CAS Name: 5-benzoyl-7-bromo-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid dodecyl ester IUPAC Name: dodecyl 5-benzoyl-7-bromo-2,3-dihydro-1H-pyrrolizine-1-carboxylate Traditional Name: 5-benzoyl-7-bromo-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid lauryl ester Formula: C27H36BrNO3 MolecularWeight: 502.48364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1CCN2C1=C(C=C2C(=O)C3=CC=CC=C3)Br

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1CCN2C1=C(C=C2C(=O)C3=CC=CC=C3)Br

InChI

InChI=1S/C27H36BrNO3/c1-2-3-4-5-6-7-8-9-10-14-19-32-27(31)22-17-18-29-24(20-23(28)25(22)29)26(30)21-15-12-11-13-16-21/h11-13,15-16,20,22H,2-10,14,17-19H2,1H3