4-(1-azanylethyl)-3-chloranyl-benzoate

Systemtic Name: 4-(1-azanylethyl)-3-chloranyl-benzoate Openeye Name: 4-(1-aminoethyl)-3-chloro-benzoate CAS Name: 4-(1-aminoethyl)-3-chlorobenzoate IUPAC Name: 4-(1-aminoethyl)-3-chlorobenzoate Traditional Name: 4-(1-aminoethyl)-3-chloro-benzoate Formula: C9H9ClNO2- MolecularWeight: 198.62626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)C(=O)[O-])Cl)N

Isomeric SMILES

CC(C1=C(C=C(C=C1)C(=O)[O-])Cl)N

InChI

InChI=1S/C9H10ClNO2/c1-5(11)7-3-2-6(9(12)13)4-8(7)10/h2-5H,11H2,1H3,(H,12,13)/p-1