5-(4,7-diphenyl-1H-benzo[b][1,10]phenanthrolin-12-yl)pentanoic acid

Systemtic Name: 5-(4,7-diphenyl-1H-benzo[b][1,10]phenanthrolin-12-yl)pentanoic acid Openeye Name: 5-(4,7-diphenyl-1H-benzo[b][1,10]phenanthrolin-12-yl)pentanoic acid CAS Name: 5-(4,7-diphenyl-1H-benzo[b][1,10]phenanthrolin-12-yl)pentanoic acid IUPAC Name: 5-(4,7-diphenyl-1H-benzo[b][1,10]phenanthrolin-12-yl)pentanoic acid Traditional Name: 5-(4,7-diphenyl-1H-benzo[b][1,10]phenanthrolin-12-yl)valeric acid Formula: C33H28N2O2 MolecularWeight: 484.58762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC4=C(C5=CC=CC=C5N(C4=C3NC=C2)CCCCC(=O)O)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC4=C(C5=CC=CC=C5N(C4=C3NC=C2)CCCCC(=O)O)C6=CC=CC=C6

InChI

InChI=1S/C33H28N2O2/c36-30(37)17-9-10-22-35-29-16-8-7-15-27(29)31(24-13-5-2-6-14-24)28-19-18-26-25(23-11-3-1-4-12-23)20-21-34-32(26)33(28)35/h1-8,11-16,18-21,34H,9-10,17,22H2,(H,36,37)