N-methanoyl-N-(3-nitro-5,10,15,20-tetraphenyl-23,24-dihydroporphyrin-2-yl)ethanamide

Systemtic Name: N-methanoyl-N-(3-nitro-5,10,15,20-tetraphenyl-23,24-dihydroporphyrin-2-yl)ethanamide Openeye Name: N-formyl-N-(3-nitro-5,10,15,20-tetraphenyl-23,24-dihydroporphyrin-2-yl)acetamide CAS Name: N-formyl-N-(3-nitro-5,10,15,20-tetraphenyl-23,24-dihydroporphyrin-2-yl)acetamide IUPAC Name: N-formyl-N-(3-nitro-5,10,15,20-tetraphenyl-23,24-dihydroporphyrin-2-yl)acetamide Traditional Name: N-formyl-N-(3-nitro-5,10,15,20-tetraphenyl-23,24-dihydroporphin-2-yl)acetamide Formula: C47H32N6O4 MolecularWeight: 744.79478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C=O)C1=C(C2=NC1=C(C3=CC=C(N3)C(=C4C=CC(=C(C5=NC(=C2C6=CC=CC=C6)C=C5)C7=CC=CC=C7)N4)C8=CC=CC=C8)C9=CC=CC=C9)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N(C=O)C1=C(C2=NC1=C(C3=CC=C(N3)C(=C4C=CC(=C(C5=NC(=C2C6=CC=CC=C6)C=C5)C7=CC=CC=C7)N4)C8=CC=CC=C8)C9=CC=CC=C9)[N+](=O)[O-]

InChI

InChI=1S/C47H32N6O4/c1-29(55)52(28-54)46-44-42(32-18-10-4-11-19-32)38-26-24-36(49-38)40(30-14-6-2-7-15-30)34-22-23-35(48-34)41(31-16-8-3-9-17-31)37-25-27-39(50-37)43(33-20-12-5-13-21-33)45(51-44)47(46)53(56)57/h2-28,48-49H,1H3