3-(8,13-diethyl-7,12,17-trimethyl-21,24-dihydroporphyrin-2-yl)propanoic acid

Systemtic Name: 3-(8,13-diethyl-7,12,17-trimethyl-21,24-dihydroporphyrin-2-yl)propanoic acid Openeye Name: 3-(8,13-diethyl-7,12,17-trimethyl-21,24-dihydroporphyrin-2-yl)propanoic acid CAS Name: 3-(8,13-diethyl-7,12,17-trimethyl-21,24-dihydroporphyrin-2-yl)propanoic acid IUPAC Name: 3-(8,13-diethyl-7,12,17-trimethyl-21,24-dihydroporphyrin-2-yl)propanoic acid Traditional Name: 3-(8,13-diethyl-7,12,17-trimethyl-21,24-dihydroporphin-2-yl)propionic acid Formula: C30H32N4O2 MolecularWeight: 480.60068

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC3=NC(=CC4=CC(=C(N4)C=C5C=C(C(=CC1=N2)N5)C)CCC(=O)O)C(=C3CC)C)C

Isomeric SMILES

CCC1=C(C2=CC3=NC(=CC4=CC(=C(N4)C=C5C=C(C(=CC1=N2)N5)C)CCC(=O)O)C(=C3CC)C)C

InChI

InChI=1S/C30H32N4O2/c1-6-22-17(4)25-12-21-11-19(8-9-30(35)36)27(32-21)13-20-10-16(3)24(31-20)14-28-23(7-2)18(5)26(34-28)15-29(22)33-25/h10-15,31-32H,6-9H2,1-5H3,(H,35,36)