4-chloranyl-N-[4-(10,15,20-triphenyl-23,24-dihydroporphyrin-5-yl)phenyl]butanamide

Systemtic Name: 4-chloranyl-N-[4-(10,15,20-triphenyl-23,24-dihydroporphyrin-5-yl)phenyl]butanamide Openeye Name: 4-chloro-N-[4-(10,15,20-triphenyl-23,24-dihydroporphyrin-5-yl)phenyl]butanamide CAS Name: 4-chloro-N-[4-(10,15,20-triphenyl-23,24-dihydroporphyrin-5-yl)phenyl]butanamide IUPAC Name: 4-chloro-N-[4-(10,15,20-triphenyl-23,24-dihydroporphyrin-5-yl)phenyl]butanamide Traditional Name: 4-chloro-N-[4-(10,15,20-triphenyl-23,24-dihydroporphin-5-yl)phenyl]butyramide Formula: C48H36ClN5O MolecularWeight: 734.28534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)NC(=O)CCCCl)C8=CC=CC=C8)C9=CC=CC=C9)N3

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)NC(=O)CCCCl)C8=CC=CC=C8)C9=CC=CC=C9)N3

InChI

InChI=1S/C48H36ClN5O/c49-30-10-17-44(55)50-35-20-18-34(19-21-35)48-42-28-26-40(53-42)46(32-13-6-2-7-14-32)38-24-22-36(51-38)45(31-11-4-1-5-12-31)37-23-25-39(52-37)47(33-15-8-3-9-16-33)41-27-29-43(48)54-41/h1-9,11-16,18-29,51-52H,10,17,30H2,(H,50,55)