15-butyl-5-chloranyl-10,20-diphenyl-21,22-dihydroporphyrin

Systemtic Name: 15-butyl-5-chloranyl-10,20-diphenyl-21,22-dihydroporphyrin Openeye Name: 15-butyl-5-chloro-10,20-diphenyl-21,22-dihydroporphyrin CAS Name: 15-butyl-5-chloro-10,20-diphenyl-21,22-dihydroporphyrin IUPAC Name: 15-butyl-5-chloro-10,20-diphenyl-21,22-dihydroporphyrin Traditional Name: 15-butyl-5-chloro-10,20-diphenyl-21,22-dihydroporphine Formula: C36H29ClN4 MolecularWeight: 553.09526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C=CC(=N2)C(=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC1=N5)C6=CC=CC=C6)Cl)N3)C7=CC=CC=C7

Isomeric SMILES

CCCCC1=C2C=CC(=N2)C(=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC1=N5)C6=CC=CC=C6)Cl)N3)C7=CC=CC=C7

InChI

InChI=1S/C36H29ClN4/c1-2-3-14-25-26-15-17-28(38-26)34(23-10-6-4-7-11-23)30-19-21-32(40-30)36(37)33-22-20-31(41-33)35(24-12-8-5-9-13-24)29-18-16-27(25)39-29/h4-13,15-22,40-41H,2-3,14H2,1H3