1-(7,8,21,23-tetrahydroporphyrin-2-yl)ethanone

Systemtic Name: 1-(7,8,21,23-tetrahydroporphyrin-2-yl)ethanone Openeye Name: 1-(7,8,21,23-tetrahydroporphyrin-2-yl)ethanone CAS Name: 1-(7,8,21,23-tetrahydroporphyrin-2-yl)ethanone IUPAC Name: 1-(7,8,21,23-tetrahydroporphyrin-2-yl)ethanone Traditional Name: 1-(7,8,21,23-tetrahydroporphin-2-yl)ethanone Formula: C22H18N4O MolecularWeight: 354.40452

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C2C=C3C=CC(=N3)C=C4C=CC(=CC5=NC(=CC(=C1)N2)CC5)N4

Isomeric SMILES

CC(=O)C1=C2C=C3C=CC(=N3)C=C4C=CC(=CC5=NC(=CC(=C1)N2)CC5)N4

InChI

InChI=1S/C22H18N4O/c1-13(27)21-11-20-10-18-5-4-16(24-18)8-14-2-3-15(23-14)9-17-6-7-19(25-17)12-22(21)26-20/h2-3,6-12,23,26H,4-5H2,1H3