diethyl 5-(4-bromanylbutyl)-6-phenyl-1H-phenanthridine-3,8-dicarboxylate

Systemtic Name: diethyl 5-(4-bromanylbutyl)-6-phenyl-1H-phenanthridine-3,8-dicarboxylate Openeye Name: diethyl 5-(4-bromobutyl)-6-phenyl-1H-phenanthridine-3,8-dicarboxylate CAS Name: 5-(4-bromobutyl)-6-phenyl-1H-phenanthridine-3,8-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(4-bromobutyl)-6-phenyl-1H-phenanthridine-3,8-dicarboxylate Traditional Name: 5-(4-bromobutyl)-6-phenyl-1H-phenanthridine-3,8-dicarboxylic acid diethyl ester Formula: C29H30BrNO4 MolecularWeight: 536.4568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CCC2=C3C=CC(=CC3=C(N(C2=C1)CCCCBr)C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CCC2=C3C=CC(=CC3=C(N(C2=C1)CCCCBr)C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C29H30BrNO4/c1-3-34-28(32)21-12-14-23-24-15-13-22(29(33)35-4-2)19-26(24)31(17-9-8-16-30)27(25(23)18-21)20-10-6-5-7-11-20/h5-7,10-14,18-19H,3-4,8-9,15-17H2,1-2H3