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zinc (E)-[15-(4-aminophenyl)porphyrin-22-id-5-ylidene]methanolate

zinc (E)-[15-(4-aminophenyl)porphyrin-22-id-5-ylidene]methanolate

Systemtic Name:zinc (E)-[15-(4-aminophenyl)porphyrin-22-id-5-ylidene]methanolate
Openeye Name:zinc (E)-[15-(4-aminophenyl)porphyrin-22-id-5-ylidene]methanolate
CAS Name:zinc (E)-[15-(4-aminophenyl)-5-porphyrin-22-idylidene]methanolate
IUPAC Name:zinc (E)-[15-(4-aminophenyl)porphyrin-22-id-5-ylidene]methanolate
Traditional Name:zinc (E)-[15-(4-aminophenyl)porphin-22-id-5-ylidene]methanolate
Formula: C27H17N5OZn
MolecularWeight: 492.86578
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C3C=CC(=N3)C=C4C=CC(=N4)C(=C[O-])C5=CC=C([N-]5)C=C6C=CC2=N6)N.[Zn+2]


Isomeric SMILES

C1=CC(=CC=C1C2=C3C=CC(=N3)C=C4C=CC(=N4)/C(=C/[O-])/C5=CC=C([N-]5)C=C6C=CC2=N6)N.[Zn+2]


InChI

InChI=1S/C27H18N5O.Zn/c28-17-3-1-16(2-4-17)27-25-11-7-20(31-25)13-18-5-9-23(29-18)22(15-33)24-10-6-19(30-24)14-21-8-12-26(27)32-21;/h1-15H,(H3-,28,29,30,31,32,33);/q-1;+2/p-1


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