[2-[[(2S)-2-ethylhexyl]amino]-2-oxidanylidene-ethyl] 4-azanylbenzoate

Systemtic Name: [2-[[(2S)-2-ethylhexyl]amino]-2-oxidanylidene-ethyl] 4-azanylbenzoate Openeye Name: [2-[[(2S)-2-ethylhexyl]amino]-2-oxo-ethyl] 4-aminobenzoate CAS Name: 4-aminobenzoic acid [2-[[(2S)-2-ethylhexyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-2-ethylhexyl]amino]-2-oxoethyl] 4-aminobenzoate Traditional Name: 4-aminobenzoic acid [2-[[(2S)-2-ethylhexyl]amino]-2-keto-ethyl] ester Formula: C17H26N2O3 MolecularWeight: 306.39994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)COC(=O)C1=CC=C(C=C1)N

Isomeric SMILES

CCCC[C@H](CC)CNC(=O)COC(=O)C1=CC=C(C=C1)N

InChI

InChI=1S/C17H26N2O3/c1-3-5-6-13(4-2)11-19-16(20)12-22-17(21)14-7-9-15(18)10-8-14/h7-10,13H,3-6,11-12,18H2,1-2H3,(H,19,20)/t13-/m0/s1