diethyl 1-(4-bromanyl-2-methyl-phenyl)-2-phenyl-pyrrolidine-3,3-dicarboxylate

Systemtic Name: diethyl 1-(4-bromanyl-2-methyl-phenyl)-2-phenyl-pyrrolidine-3,3-dicarboxylate Openeye Name: diethyl 1-(4-bromo-2-methyl-phenyl)-2-phenyl-pyrrolidine-3,3-dicarboxylate CAS Name: 1-(4-bromo-2-methylphenyl)-2-phenylpyrrolidine-3,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-(4-bromo-2-methylphenyl)-2-phenylpyrrolidine-3,3-dicarboxylate Traditional Name: 1-(4-bromo-2-methyl-phenyl)-2-phenyl-pyrrolidine-3,3-dicarboxylic acid diethyl ester Formula: C23H26BrNO4 MolecularWeight: 460.36084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(C1C2=CC=CC=C2)C3=C(C=C(C=C3)Br)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CCN(C1C2=CC=CC=C2)C3=C(C=C(C=C3)Br)C)C(=O)OCC

InChI

InChI=1S/C23H26BrNO4/c1-4-28-21(26)23(22(27)29-5-2)13-14-25(19-12-11-18(24)15-16(19)3)20(23)17-9-7-6-8-10-17/h6-12,15,20H,4-5,13-14H2,1-3H3