tert-butyl 2-[2-(4-chlorophenyl)-6,6-dimethyl-7-oxidanylidene-1-phenyl-5H-pyrrolizin-3-yl]ethanoate

Systemtic Name: tert-butyl 2-[2-(4-chlorophenyl)-6,6-dimethyl-7-oxidanylidene-1-phenyl-5H-pyrrolizin-3-yl]ethanoate Openeye Name: tert-butyl 2-[2-(4-chlorophenyl)-6,6-dimethyl-7-oxo-1-phenyl-5H-pyrrolizin-3-yl]acetate CAS Name: 2-[2-(4-chlorophenyl)-6,6-dimethyl-7-oxo-1-phenyl-5H-pyrrolizin-3-yl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-(4-chlorophenyl)-6,6-dimethyl-7-oxo-1-phenyl-5H-pyrrolizin-3-yl]acetate Traditional Name: 2-[2-(4-chlorophenyl)-7-keto-6,6-dimethyl-1-phenyl-5H-pyrrolizin-3-yl]acetic acid tert-butyl ester Formula: C27H28ClNO3 MolecularWeight: 449.96912

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN2C(=C(C(=C2C1=O)C3=CC=CC=C3)C4=CC=C(C=C4)Cl)CC(=O)OC(C)(C)C)C

Isomeric SMILES

CC1(CN2C(=C(C(=C2C1=O)C3=CC=CC=C3)C4=CC=C(C=C4)Cl)CC(=O)OC(C)(C)C)C

InChI

InChI=1S/C27H28ClNO3/c1-26(2,3)32-21(30)15-20-22(18-11-13-19(28)14-12-18)23(17-9-7-6-8-10-17)24-25(31)27(4,5)16-29(20)24/h6-14H,15-16H2,1-5H3