2,6-bis(azanyl)-1-(7,8,21,23-tetrahydroporphyrin-2-yl)hexan-1-one

Systemtic Name: 2,6-bis(azanyl)-1-(7,8,21,23-tetrahydroporphyrin-2-yl)hexan-1-one Openeye Name: 2,6-diamino-1-(7,8,21,23-tetrahydroporphyrin-2-yl)hexan-1-one CAS Name: 2,6-diamino-1-(7,8,21,23-tetrahydroporphyrin-2-yl)-1-hexanone IUPAC Name: 2,6-diamino-1-(7,8,21,23-tetrahydroporphyrin-2-yl)hexan-1-one Traditional Name: 2,6-diamino-1-(7,8,21,23-tetrahydroporphin-2-yl)hexan-1-one Formula: C26H28N6O MolecularWeight: 440.54012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC1=CC3=CC(=C(N3)C=C4C=CC(=N4)C=C5C=CC(=C2)N5)C(=O)C(CCCCN)N

Isomeric SMILES

C1CC2=NC1=CC3=CC(=C(N3)C=C4C=CC(=N4)C=C5C=CC(=C2)N5)C(=O)C(CCCCN)N

InChI

InChI=1S/C26H28N6O/c27-10-2-1-3-24(28)26(33)23-14-22-13-20-7-6-18(30-20)11-16-4-5-17(29-16)12-19-8-9-21(31-19)15-25(23)32-22/h4-5,8-9,11-15,24,29,32H,1-3,6-7,10,27-28H2