ethyl N-[2-[15-[2-(ethoxycarbonylamino)phenyl]-2,8,12,18-tetraethyl-3,7,13,17-tetramethyl-21,22-dihydroporphyrin-5-yl]phenyl]carbamate

Systemtic Name: ethyl N-[2-[15-[2-(ethoxycarbonylamino)phenyl]-2,8,12,18-tetraethyl-3,7,13,17-tetramethyl-21,22-dihydroporphyrin-5-yl]phenyl]carbamate Openeye Name: ethyl N-[2-[15-[2-(ethoxycarbonylamino)phenyl]-2,8,12,18-tetraethyl-3,7,13,17-tetramethyl-21,22-dihydroporphyrin-5-yl]phenyl]carbamate CAS Name: N-[2-[15-[2-(ethoxycarbonylamino)phenyl]-2,8,12,18-tetraethyl-3,7,13,17-tetramethyl-21,22-dihydroporphyrin-5-yl]phenyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-[15-[2-(ethoxycarbonylamino)phenyl]-2,8,12,18-tetraethyl-3,7,13,17-tetramethyl-21,22-dihydroporphyrin-5-yl]phenyl]carbamate Traditional Name: N-[2-[15-[2-(carbethoxyamino)phenyl]-2,8,12,18-tetraethyl-3,7,13,17-tetramethyl-21,22-dihydroporphin-5-yl]phenyl]carbamic acid ethyl ester Formula: C50H56N6O4 MolecularWeight: 805.01744

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C3=C(C(=C(N3)C=C4C(=C(C(=N4)C(=C5C(=C(C(=N5)C=C1N2)CC)C)C6=CC=CC=C6NC(=O)OCC)C)CC)CC)C)C7=CC=CC=C7NC(=O)OCC)C

Isomeric SMILES

CCC1=C(C2=C(C3=C(C(=C(N3)C=C4C(=C(C(=N4)C(=C5C(=C(C(=N5)C=C1N2)CC)C)C6=CC=CC=C6NC(=O)OCC)C)CC)CC)C)C7=CC=CC=C7NC(=O)OCC)C

InChI

InChI=1S/C50H56N6O4/c1-11-31-27(7)45-43(35-21-17-19-23-37(35)55-49(57)59-15-5)46-29(9)33(13-3)41(53-46)26-42-34(14-4)30(10)48(54-42)44(36-22-18-20-24-38(36)56-50(58)60-16-6)47-28(8)32(12-2)40(52-47)25-39(31)51-45/h17-26,51,53H,11-16H2,1-10H3,(H,55,57)(H,56,58)