zinc 3-[3,7,12,17-tetramethyl-18-(3-oxidanylpropyl)porphyrin-21,24-diid-2-yl]propan-1-ol

Systemtic Name: zinc 3-[3,7,12,17-tetramethyl-18-(3-oxidanylpropyl)porphyrin-21,24-diid-2-yl]propan-1-ol Openeye Name: zinc 3-[18-(3-hydroxypropyl)-3,7,12,17-tetramethyl-porphyrin-21,24-diid-2-yl]propan-1-ol CAS Name: zinc 3-[18-(3-hydroxypropyl)-3,7,12,17-tetramethyl-2-porphyrin-21,24-diidyl]-1-propanol IUPAC Name: zinc 3-[18-(3-hydroxypropyl)-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propan-1-ol Traditional Name: zinc 3-[18-(3-hydroxypropyl)-3,7,12,17-tetramethyl-porphine-21,24-diid-2-yl]propan-1-ol Formula: C30H32N4O2Zn MolecularWeight: 546.00968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC1=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(=C(C(=C2)[N-]5)C)CCCO)CCCO)C)C(=C3)C.[Zn+2]

Isomeric SMILES

CC1=CC2=NC1=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(=C(C(=C2)[N-]5)C)CCCO)CCCO)C)C(=C3)C.[Zn+2]

InChI

InChI=1S/C30H32N4O2.Zn/c1-17-11-22-14-27-19(3)23(7-5-9-35)29(33-27)16-30-24(8-6-10-36)20(4)28(34-30)15-26-18(2)12-21(32-26)13-25(17)31-22;/h11-16,35-36H,5-10H2,1-4H3;/q-2;+2