2-[2-[[3-(4-methoxycarbonylphenyl)-4-[5-(phenoxymethyl)furan-2-yl]butan-2-yl]-(naphthalen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]butanedioic acid

Systemtic Name: 2-[2-[[3-(4-methoxycarbonylphenyl)-4-[5-(phenoxymethyl)furan-2-yl]butan-2-yl]-(naphthalen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]butanedioic acid Openeye Name: 2-[2-[[2-(4-methoxycarbonylphenyl)-1-methyl-3-[5-(phenoxymethyl)-2-furyl]propyl]-(2-naphthylmethyl)amino]-2-oxo-ethyl]butanedioic acid CAS Name: 2-[2-[[3-(4-methoxycarbonylphenyl)-4-[5-(phenoxymethyl)-2-furanyl]butan-2-yl]-(2-naphthalenylmethyl)amino]-2-oxoethyl]butanedioic acid IUPAC Name: 2-[2-[[3-(4-methoxycarbonylphenyl)-4-[5-(phenoxymethyl)furan-2-yl]butan-2-yl]-(naphthalen-2-ylmethyl)amino]-2-oxoethyl]butanedioic acid Traditional Name: 2-[2-[[2-(4-carbomethoxyphenyl)-1-methyl-3-[5-(phenoxymethyl)-2-furyl]propyl]-(2-naphthylmethyl)amino]-2-keto-ethyl]succinic acid Formula: C40H39NO9 MolecularWeight: 677.73896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC=C(O1)COC2=CC=CC=C2)C3=CC=C(C=C3)C(=O)OC)N(CC4=CC5=CC=CC=C5C=C4)C(=O)CC(CC(=O)O)C(=O)O

Isomeric SMILES

CC(C(CC1=CC=C(O1)COC2=CC=CC=C2)C3=CC=C(C=C3)C(=O)OC)N(CC4=CC5=CC=CC=C5C=C4)C(=O)CC(CC(=O)O)C(=O)O

InChI

InChI=1S/C40H39NO9/c1-26(41(37(42)21-32(39(45)46)22-38(43)44)24-27-12-13-28-8-6-7-9-31(28)20-27)36(29-14-16-30(17-15-29)40(47)48-2)23-34-18-19-35(50-34)25-49-33-10-4-3-5-11-33/h3-20,26,32,36H,21-25H2,1-2H3,(H,43,44)(H,45,46)