2-azanyl-14-[[7-(diethylamino)-2-oxidanylidene-chromen-3-yl]carbonyl-methyl-amino]-3-oxidanylidene-2-tetradecyl-icosanoic acid

Systemtic Name: 2-azanyl-14-[[7-(diethylamino)-2-oxidanylidene-chromen-3-yl]carbonyl-methyl-amino]-3-oxidanylidene-2-tetradecyl-icosanoic acid Openeye Name: 2-amino-14-[[7-(diethylamino)-2-oxo-chromene-3-carbonyl]-methyl-amino]-3-oxo-2-tetradecyl-icosanoic acid CAS Name: 2-amino-14-[[[7-(diethylamino)-2-oxo-1-benzopyran-3-yl]-oxomethyl]-methylamino]-3-oxo-2-tetradecyleicosanoic acid IUPAC Name: 2-amino-14-[[7-(diethylamino)-2-oxochromene-3-carbonyl]-methylamino]-3-oxo-2-tetradecylicosanoic acid Traditional Name: 2-amino-14-[[7-(diethylamino)-2-keto-chromene-3-carbonyl]-methyl-amino]-3-keto-2-myristyl-arachidic acid Formula: C49H83N3O6 MolecularWeight: 810.19982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(=O)CCCCCCCCCCC(CCCCCC)N(C)C(=O)C1=CC2=C(C=C(C=C2)N(CC)CC)OC1=O)(C(=O)O)N

Isomeric SMILES

CCCCCCCCCCCCCCC(C(=O)CCCCCCCCCCC(CCCCCC)N(C)C(=O)C1=CC2=C(C=C(C=C2)N(CC)CC)OC1=O)(C(=O)O)N

InChI

InChI=1S/C49H83N3O6/c1-6-10-12-14-15-16-17-18-21-24-27-31-37-49(50,48(56)57)45(53)34-30-26-23-20-19-22-25-29-33-41(32-28-13-11-7-2)51(5)46(54)43-38-40-35-36-42(52(8-3)9-4)39-44(40)58-47(43)55/h35-36,38-39,41H,6-34,37,50H2,1-5H3,(H,56,57)