(2S)-1-[(10-bromanyl-3,6,7-trimethoxy-phenanthren-9-yl)methyl]-N,N-diethyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[(10-bromanyl-3,6,7-trimethoxy-phenanthren-9-yl)methyl]-N,N-diethyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[(10-bromo-3,6,7-trimethoxy-9-phenanthryl)methyl]-N,N-diethyl-pyrrolidine-2-carboxamide CAS Name: (2S)-1-[(10-bromo-3,6,7-trimethoxy-9-phenanthrenyl)methyl]-N,N-diethyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[(10-bromo-3,6,7-trimethoxyphenanthren-9-yl)methyl]-N,N-diethylpyrrolidine-2-carboxamide Traditional Name: (2S)-1-[(10-bromo-3,6,7-trimethoxy-9-phenanthryl)methyl]-N,N-diethyl-pyrrolidine-2-carboxamide Formula: C27H33BrN2O4 MolecularWeight: 529.46592

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCCN1CC2=C(C3=C(C=C(C=C3)OC)C4=CC(=C(C=C42)OC)OC)Br

Isomeric SMILES

CCN(CC)C(=O)[C@@H]1CCCN1CC2=C(C3=C(C=C(C=C3)OC)C4=CC(=C(C=C42)OC)OC)Br

InChI

InChI=1S/C27H33BrN2O4/c1-6-29(7-2)27(31)23-9-8-12-30(23)16-22-21-15-25(34-5)24(33-4)14-20(21)19-13-17(32-3)10-11-18(19)26(22)28/h10-11,13-15,23H,6-9,12,16H2,1-5H3/t23-/m0/s1