[2-(hexylamino)-2-oxidanylidene-ethyl] 3-azanyl-4-chloranyl-benzoate

Systemtic Name: [2-(hexylamino)-2-oxidanylidene-ethyl] 3-azanyl-4-chloranyl-benzoate Openeye Name: [2-(hexylamino)-2-oxo-ethyl] 3-amino-4-chloro-benzoate CAS Name: 3-amino-4-chlorobenzoic acid [2-(hexylamino)-2-oxoethyl] ester IUPAC Name: [2-(hexylamino)-2-oxoethyl] 3-amino-4-chlorobenzoate Traditional Name: 3-amino-4-chloro-benzoic acid [2-(hexylamino)-2-keto-ethyl] ester Formula: C15H21ClN2O3 MolecularWeight: 312.79184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)COC(=O)C1=CC(=C(C=C1)Cl)N

Isomeric SMILES

CCCCCCNC(=O)COC(=O)C1=CC(=C(C=C1)Cl)N

InChI

InChI=1S/C15H21ClN2O3/c1-2-3-4-5-8-18-14(19)10-21-15(20)11-6-7-12(16)13(17)9-11/h6-7,9H,2-5,8,10,17H2,1H3,(H,18,19)