bis[3-(dibutylamino)propyl] 9-oxidanylphenanthrene-2,7-dicarboxylate

Systemtic Name: bis[3-(dibutylamino)propyl] 9-oxidanylphenanthrene-2,7-dicarboxylate Openeye Name: bis[3-(dibutylamino)propyl] 9-hydroxyphenanthrene-2,7-dicarboxylate CAS Name: 9-hydroxyphenanthrene-2,7-dicarboxylic acid bis[3-(dibutylamino)propyl] ester IUPAC Name: bis[3-(dibutylamino)propyl] 9-hydroxyphenanthrene-2,7-dicarboxylate Traditional Name: 9-hydroxyphenanthrene-2,7-dicarboxylic acid bis[3-(dibutylamino)propyl] ester Formula: C38H56N2O5 MolecularWeight: 620.86164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCOC(=O)C1=CC2=CC(=C3C=C(C=CC3=C2C=C1)C(=O)OCCCN(CCCC)CCCC)O

Isomeric SMILES

CCCCN(CCCC)CCCOC(=O)C1=CC2=CC(=C3C=C(C=CC3=C2C=C1)C(=O)OCCCN(CCCC)CCCC)O

InChI

InChI=1S/C38H56N2O5/c1-5-9-19-39(20-10-6-2)23-13-25-44-37(42)30-15-17-33-32(27-30)29-36(41)35-28-31(16-18-34(33)35)38(43)45-26-14-24-40(21-11-7-3)22-12-8-4/h15-18,27-29,41H,5-14,19-26H2,1-4H3