methyl 3-[2-[[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[[2-(2-ethylanilino)-2-oxo-ethyl]-methyl-amino]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[[2-(2-ethylanilino)-2-oxoethyl]-methylamino]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[[2-(2-ethylanilino)-2-oxoethyl]-methylamino]acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[[2-(2-ethylanilino)-2-keto-ethyl]-methyl-amino]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN(C)CC(=O)NC2=C(C=CC(=C2)C(=O)OC)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN(C)CC(=O)NC2=C(C=CC(=C2)C(=O)OC)C

InChI

InChI=1S/C22H27N3O4/c1-5-16-8-6-7-9-18(16)23-20(26)13-25(3)14-21(27)24-19-12-17(22(28)29-4)11-10-15(19)2/h6-12H,5,13-14H2,1-4H3,(H,23,26)(H,24,27)