[2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl] 6-(aminocarbonylamino)hexanoate

Systemtic Name: [2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl] 6-(aminocarbonylamino)hexanoate Openeye Name: [2-(3-ethylanilino)-2-oxo-ethyl] 6-ureidohexanoate CAS Name: 6-(carbamoylamino)hexanoic acid [2-(3-ethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-ethylanilino)-2-oxoethyl] 6-(carbamoylamino)hexanoate Traditional Name: 6-ureidohexanoic acid [2-(3-ethylanilino)-2-keto-ethyl] ester Formula: C17H25N3O4 MolecularWeight: 335.3981

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)COC(=O)CCCCCNC(=O)N

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)COC(=O)CCCCCNC(=O)N

InChI

InChI=1S/C17H25N3O4/c1-2-13-7-6-8-14(11-13)20-15(21)12-24-16(22)9-4-3-5-10-19-17(18)23/h6-8,11H,2-5,9-10,12H2,1H3,(H,20,21)(H3,18,19,23)