zinc 10,15,20-triphenyl-N,N-dipropyl-porphyrin-23,24-diid-5-amine

Systemtic Name: zinc 10,15,20-triphenyl-N,N-dipropyl-porphyrin-23,24-diid-5-amine Openeye Name: zinc 10,15,20-triphenyl-N,N-dipropyl-porphyrin-23,24-diid-5-amine CAS Name: zinc 10,15,20-triphenyl-N,N-dipropyl-5-porphyrin-23,24-diidamine IUPAC Name: zinc 10,15,20-triphenyl-N,N-dipropylporphyrin-23,24-diid-5-amine Traditional Name: zinc dipropyl-(10,15,20-triphenylporphine-23,24-diid-5-yl)amine Formula: C44H37N5Zn MolecularWeight: 701.20708

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=C2C=CC(=N2)C(=C3C=CC(=C(C4=CC=C([N-]4)C(=C5C=CC1=N5)C6=CC=CC=C6)C7=CC=CC=C7)[N-]3)C8=CC=CC=C8.[Zn+2]

Isomeric SMILES

CCCN(CCC)C1=C2C=CC(=N2)C(=C3C=CC(=C(C4=CC=C([N-]4)C(=C5C=CC1=N5)C6=CC=CC=C6)C7=CC=CC=C7)[N-]3)C8=CC=CC=C8.[Zn+2]

InChI

InChI=1S/C44H37N5.Zn/c1-3-28-49(29-4-2)44-39-26-24-37(47-39)42(31-16-10-6-11-17-31)35-22-20-33(45-35)41(30-14-8-5-9-15-30)34-21-23-36(46-34)43(32-18-12-7-13-19-32)38-25-27-40(44)48-38;/h5-27H,3-4,28-29H2,1-2H3;/q-2;+2