(10,20-dihexyl-23,24-dihydroporphyrin-5-yl)-phenyl-methanol

Systemtic Name: (10,20-dihexyl-23,24-dihydroporphyrin-5-yl)-phenyl-methanol Openeye Name: (10,20-dihexyl-23,24-dihydroporphyrin-5-yl)-phenyl-methanol CAS Name: (10,20-dihexyl-23,24-dihydroporphyrin-5-yl)-phenylmethanol IUPAC Name: (10,20-dihexyl-23,24-dihydroporphyrin-5-yl)-phenylmethanol Traditional Name: (10,20-dihexyl-23,24-dihydroporphin-5-yl)-phenyl-methanol Formula: C39H44N4O MolecularWeight: 584.79286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C2C=CC(=CC3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC1=N5)C(C6=CC=CC=C6)O)CCCCCC)N2

Isomeric SMILES

CCCCCCC1=C2C=CC(=CC3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC1=N5)C(C6=CC=CC=C6)O)CCCCCC)N2

InChI

InChI=1S/C39H44N4O/c1-3-5-7-12-16-30-32-20-18-28(40-32)26-29-19-21-33(41-29)31(17-13-8-6-4-2)35-23-25-37(43-35)38(36-24-22-34(30)42-36)39(44)27-14-10-9-11-15-27/h9-11,14-15,18-26,39-41,44H,3-8,12-13,16-17H2,1-2H3