2,7-diethyl-3,8,12,18-tetramethyl-13,17-bis(3-phenylmethoxypropyl)-21,22-dihydroporphyrin

Systemtic Name: 2,7-diethyl-3,8,12,18-tetramethyl-13,17-bis(3-phenylmethoxypropyl)-21,22-dihydroporphyrin Openeye Name: 13,17-bis(3-benzyloxypropyl)-2,7-diethyl-3,8,12,18-tetramethyl-21,22-dihydroporphyrin CAS Name: 2,7-diethyl-3,8,12,18-tetramethyl-13,17-bis(3-phenylmethoxypropyl)-21,22-dihydroporphyrin IUPAC Name: 2,7-diethyl-3,8,12,18-tetramethyl-13,17-bis(3-phenylmethoxypropyl)-21,22-dihydroporphyrin Traditional Name: 13,17-bis(3-benzoxypropyl)-2,7-diethyl-3,8,12,18-tetramethyl-21,22-dihydroporphine Formula: C48H54N4O2 MolecularWeight: 718.96796

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCCOCC6=CC=CC=C6)CCCOCC7=CC=CC=C7)C)C)CC)C

Isomeric SMILES

CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCCOCC6=CC=CC=C6)CCCOCC7=CC=CC=C7)C)C)CC)C

InChI

InChI=1S/C48H54N4O2/c1-7-37-31(3)41-25-42-33(5)39(21-15-23-53-29-35-17-11-9-12-18-35)47(51-42)28-48-40(22-16-24-54-30-36-19-13-10-14-20-36)34(6)44(52-48)27-46-38(8-2)32(4)43(50-46)26-45(37)49-41/h9-14,17-20,25-28,49-50H,7-8,15-16,21-24,29-30H2,1-6H3