[2-[bis(phenylmethyl)amino]-2-oxidanylidene-ethyl] 4,5-dimethoxy-2-(3-methylbutanoylamino)benzoate

Systemtic Name: [2-[bis(phenylmethyl)amino]-2-oxidanylidene-ethyl] 4,5-dimethoxy-2-(3-methylbutanoylamino)benzoate Openeye Name: [2-(dibenzylamino)-2-oxo-ethyl] 4,5-dimethoxy-2-(3-methylbutanoylamino)benzoate CAS Name: 4,5-dimethoxy-2-[(3-methyl-1-oxobutyl)amino]benzoic acid [2-[bis(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-(dibenzylamino)-2-oxoethyl] 4,5-dimethoxy-2-(3-methylbutanoylamino)benzoate Traditional Name: 2-(isovalerylamino)-4,5-dimethoxy-benzoic acid [2-(dibenzylamino)-2-keto-ethyl] ester Formula: C30H34N2O6 MolecularWeight: 518.60076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC(=C(C=C1C(=O)OCC(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)OC)OC

Isomeric SMILES

CC(C)CC(=O)NC1=CC(=C(C=C1C(=O)OCC(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C30H34N2O6/c1-21(2)15-28(33)31-25-17-27(37-4)26(36-3)16-24(25)30(35)38-20-29(34)32(18-22-11-7-5-8-12-22)19-23-13-9-6-10-14-23/h5-14,16-17,21H,15,18-20H2,1-4H3,(H,31,33)