nickel; 2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-23,24-dihydroporphyrin-5-carbaldehyde

Systemtic Name: nickel; 2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-23,24-dihydroporphyrin-5-carbaldehyde Openeye Name: nickel; 2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-23,24-dihydroporphyrin-5-carbaldehyde CAS Name: nickel; 2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-23,24-dihydroporphyrin-5-carboxaldehyde IUPAC Name: nickel; 2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-23,24-dihydroporphyrin-5-carbaldehyde Traditional Name: nickel; 2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-23,24-dihydroporphine-5-carbaldehyde Formula: C33H38N4NiO MolecularWeight: 565.37442

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C(=C5C(=C(C(=N5)C=C1N2)C)CC)C=O)C)CC)C)CC)C.[Ni]

Isomeric SMILES

CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C(=C5C(=C(C(=N5)C=C1N2)C)CC)C=O)C)CC)C)CC)C.[Ni]

InChI

InChI=1S/C33H38N4O.Ni/c1-9-21-18(6)27-14-31-23(11-3)20(8)32(37-31)25(16-38)33-24(12-4)19(7)28(36-33)15-30-22(10-2)17(5)26(34-30)13-29(21)35-27;/h13-16,34-35H,9-12H2,1-8H3;