10,20-bis(bromanyl)-15-butyl-5-(2,4,6-trimethoxyphenyl)-21,22-dihydroporphyrin

Systemtic Name: 10,20-bis(bromanyl)-15-butyl-5-(2,4,6-trimethoxyphenyl)-21,22-dihydroporphyrin Openeye Name: 10,20-dibromo-15-butyl-5-(2,4,6-trimethoxyphenyl)-21,22-dihydroporphyrin CAS Name: 10,20-dibromo-15-butyl-5-(2,4,6-trimethoxyphenyl)-21,22-dihydroporphyrin IUPAC Name: 10,20-dibromo-15-butyl-5-(2,4,6-trimethoxyphenyl)-21,22-dihydroporphyrin Traditional Name: 10,20-dibromo-15-butyl-5-(2,4,6-trimethoxyphenyl)-21,22-dihydroporphine Formula: C33H30Br2N4O3 MolecularWeight: 690.4243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C=CC(=N2)C(=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC1=N5)Br)C6=C(C=C(C=C6OC)OC)OC)N3)Br

Isomeric SMILES

CCCCC1=C2C=CC(=N2)C(=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC1=N5)Br)C6=C(C=C(C=C6OC)OC)OC)N3)Br

InChI

InChI=1S/C33H30Br2N4O3/c1-5-6-7-19-20-8-12-24(36-20)32(34)26-14-10-22(38-26)30(31-28(41-3)16-18(40-2)17-29(31)42-4)23-11-15-27(39-23)33(35)25-13-9-21(19)37-25/h8-17,38-39H,5-7H2,1-4H3