propan-2-yl 4-[2-[[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]ethanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[2-[[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]ethanoylamino]benzoate Openeye Name: isopropyl 4-[[2-[[2-(3-methoxyanilino)-2-oxo-ethyl]-methyl-amino]acetyl]amino]benzoate CAS Name: 4-[[2-[[2-(3-methoxyanilino)-2-oxoethyl]-methylamino]-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-[[2-(3-methoxyanilino)-2-oxoethyl]-methylamino]acetyl]amino]benzoate Traditional Name: 4-[[2-[[2-keto-2-(m-anisidino)ethyl]-methyl-amino]acetyl]amino]benzoic acid isopropyl ester Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CN(C)CC(=O)NC2=CC(=CC=C2)OC

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CN(C)CC(=O)NC2=CC(=CC=C2)OC

InChI

InChI=1S/C22H27N3O5/c1-15(2)30-22(28)16-8-10-17(11-9-16)23-20(26)13-25(3)14-21(27)24-18-6-5-7-19(12-18)29-4/h5-12,15H,13-14H2,1-4H3,(H,23,26)(H,24,27)