dimethyl (2R,3S)-1-(phenanthren-2-ylmethyl)piperazine-2,3-dicarboxylate

Systemtic Name: dimethyl (2R,3S)-1-(phenanthren-2-ylmethyl)piperazine-2,3-dicarboxylate Openeye Name: dimethyl (2R,3S)-1-(2-phenanthrylmethyl)piperazine-2,3-dicarboxylate CAS Name: (2R,3S)-1-(2-phenanthrenylmethyl)piperazine-2,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2R,3S)-1-(phenanthren-2-ylmethyl)piperazine-2,3-dicarboxylate Traditional Name: (2R,3S)-1-(2-phenanthrylmethyl)piperazine-2,3-dicarboxylic acid dimethyl ester Formula: C23H24N2O4 MolecularWeight: 392.44766

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(N(CCN1)CC2=CC3=C(C=C2)C4=CC=CC=C4C=C3)C(=O)OC

Isomeric SMILES

COC(=O)[C@@H]1[C@@H](N(CCN1)CC2=CC3=C(C=C2)C4=CC=CC=C4C=C3)C(=O)OC

InChI

InChI=1S/C23H24N2O4/c1-28-22(26)20-21(23(27)29-2)25(12-11-24-20)14-15-7-10-19-17(13-15)9-8-16-5-3-4-6-18(16)19/h3-10,13,20-21,24H,11-12,14H2,1-2H3/t20-,21+/m0/s1