cobalt(2+); N,N-dimethyl-1-(2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-porphyrin-21,22-diid-5-yl)methanamine

Systemtic Name: cobalt(2+); N,N-dimethyl-1-(2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-porphyrin-21,22-diid-5-yl)methanamine Openeye Name: cobaltous N,N-dimethyl-1-(2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-porphyrin-21,22-diid-5-yl)methanamine CAS Name: cobalt(2+); N,N-dimethyl-1-(2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-5-porphyrin-21,22-diidyl)methanamine IUPAC Name: cobalt(2+); N,N-dimethyl-1-(2,7,12,17-tetraethyl-3,8,13,18-tetramethylporphyrin-21,22-diid-5-yl)methanamine Traditional Name: cobaltous dimethyl-[(2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-porphine-21,22-diid-5-yl)methyl]amine Formula: C35H43CoN5 MolecularWeight: 592.68262

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C([N-]5)C(=C1[N-]2)CN(C)C)C)CC)C(=C4CC)C)C(=C3CC)C)C.[Co+2]

Isomeric SMILES

CCC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C([N-]5)C(=C1[N-]2)CN(C)C)C)CC)C(=C4CC)C)C(=C3CC)C)C.[Co+2]

InChI

InChI=1S/C35H43N5.Co/c1-11-23-20(6)29-16-33-25(13-3)22(8)34(39-33)27(18-40(9)10)35-26(14-4)21(7)30(38-35)17-32-24(12-2)19(5)28(36-32)15-31(23)37-29;/h15-17H,11-14,18H2,1-10H3;/q-2;+2