[2-[[2-(furan-2-ylmethylcarbamoyl)phenyl]-methyl-amino]-2-oxidanylidene-ethyl] 2-benzamido-3-methyl-butanoate

Systemtic Name: [2-[[2-(furan-2-ylmethylcarbamoyl)phenyl]-methyl-amino]-2-oxidanylidene-ethyl] 2-benzamido-3-methyl-butanoate Openeye Name: [2-[2-(2-furylmethylcarbamoyl)-N-methyl-anilino]-2-oxo-ethyl] 2-benzamido-3-methyl-butanoate CAS Name: 2-benzamido-3-methylbutanoic acid [2-[2-[(2-furanylmethylamino)-oxomethyl]-N-methylanilino]-2-oxoethyl] ester IUPAC Name: [2-[2-(furan-2-ylmethylcarbamoyl)-N-methylanilino]-2-oxoethyl] 2-benzamido-3-methylbutanoate Traditional Name: 2-benzamido-3-methyl-butyric acid [2-[2-(2-furfurylcarbamoyl)-N-methyl-anilino]-2-keto-ethyl] ester Formula: C27H29N3O6 MolecularWeight: 491.53566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)N(C)C1=CC=CC=C1C(=O)NCC2=CC=CO2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)OCC(=O)N(C)C1=CC=CC=C1C(=O)NCC2=CC=CO2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H29N3O6/c1-18(2)24(29-25(32)19-10-5-4-6-11-19)27(34)36-17-23(31)30(3)22-14-8-7-13-21(22)26(33)28-16-20-12-9-15-35-20/h4-15,18,24H,16-17H2,1-3H3,(H,28,33)(H,29,32)