3-azanyl-1-(7,8,17,18,21,23-hexahydroporphyrin-2-yl)propan-1-one

Systemtic Name: 3-azanyl-1-(7,8,17,18,21,23-hexahydroporphyrin-2-yl)propan-1-one Openeye Name: 3-amino-1-(7,8,17,18,21,23-hexahydroporphyrin-2-yl)propan-1-one CAS Name: 3-amino-1-(7,8,17,18,21,23-hexahydroporphyrin-2-yl)-1-propanone IUPAC Name: 3-amino-1-(7,8,17,18,21,23-hexahydroporphyrin-2-yl)propan-1-one Traditional Name: 3-amino-1-(7,8,17,18,21,23-hexahydroporphin-2-yl)propan-1-one Formula: C23H23N5O MolecularWeight: 385.46162

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC1=CC3=CC(=C(N3)C=C4CCC(=N4)C=C5C=CC(=C2)N5)C(=O)CCN

Isomeric SMILES

C1CC2=NC1=CC3=CC(=C(N3)C=C4CCC(=N4)C=C5C=CC(=C2)N5)C(=O)CCN

InChI

InChI=1S/C23H23N5O/c24-8-7-23(29)21-12-20-11-18-4-3-16(26-18)9-14-1-2-15(25-14)10-17-5-6-19(27-17)13-22(21)28-20/h1-2,9-13,25,28H,3-8,24H2