2,3,10,12,13,15,17,18-octaethyl-20-isocyano-21,22-dihydroporphyrin

Systemtic Name: 2,3,10,12,13,15,17,18-octaethyl-20-isocyano-21,22-dihydroporphyrin Openeye Name: 2,3,10,12,13,15,17,18-octaethyl-20-isocyano-21,22-dihydroporphyrin CAS Name: 2,3,10,12,13,15,17,18-octaethyl-20-isocyano-21,22-dihydroporphyrin IUPAC Name: 2,3,10,12,13,15,17,18-octaethyl-20-isocyano-21,22-dihydroporphyrin Traditional Name: 2,3,10,12,13,15,17,18-octaethyl-20-isocyano-21,22-dihydroporphine Formula: C37H45N5 MolecularWeight: 559.7867

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=CC(=CC3=C(C(=C(N3)C(=C4C(=C(C(=N4)C(=C5C(=C(C1=N5)CC)CC)CC)CC)CC)[N+]#[C-])CC)CC)N2

Isomeric SMILES

CCC1=C2C=CC(=CC3=C(C(=C(N3)C(=C4C(=C(C(=N4)C(=C5C(=C(C1=N5)CC)CC)CC)CC)CC)[N+]#[C-])CC)CC)N2

InChI

InChI=1S/C37H45N5/c1-10-22-23(11-2)35-37(38-9)36-27(15-6)26(14-5)34(42-36)29(17-8)33-25(13-4)24(12-3)32(41-33)28(16-7)30-19-18-21(39-30)20-31(22)40-35/h18-20,39-40H,10-17H2,1-8H3