N-[(5,10,15,20-tetraphenyl-21,22-dihydroporphyrin-2-yl)methyl]aniline

Systemtic Name: N-[(5,10,15,20-tetraphenyl-21,22-dihydroporphyrin-2-yl)methyl]aniline Openeye Name: N-[(5,10,15,20-tetraphenyl-21,22-dihydroporphyrin-2-yl)methyl]aniline CAS Name: N-[(5,10,15,20-tetraphenyl-21,22-dihydroporphyrin-2-yl)methyl]aniline IUPAC Name: N-[(5,10,15,20-tetraphenyl-21,22-dihydroporphyrin-2-yl)methyl]aniline Traditional Name: phenyl-[(5,10,15,20-tetraphenyl-21,22-dihydroporphin-2-yl)methyl]amine Formula: C51H37N5 MolecularWeight: 719.87298

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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=CC=C7)C8=CC=CC=C8)CNC9=CC=CC=C9)C1=CC=CC=C1)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=CC=C7)C8=CC=CC=C8)CNC9=CC=CC=C9)C1=CC=CC=C1)N3

InChI

InChI=1S/C51H37N5/c1-6-16-34(17-7-1)47-40-26-27-41(53-40)48(35-18-8-2-9-19-35)43-30-31-45(55-43)50(37-22-12-4-13-23-37)51-38(33-52-39-24-14-5-15-25-39)32-46(56-51)49(36-20-10-3-11-21-36)44-29-28-42(47)54-44/h1-32,52,54,56H,33H2