2-thiomorpholin-4-ylethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: 2-thiomorpholin-4-ylethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: 2-thiomorpholinoethyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid 2-thiomorpholin-4-ylethyl ester IUPAC Name: 2-thiomorpholin-4-ylethyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid 2-thiomorpholinoethyl ester Formula: C14H19ClN2O3S MolecularWeight: 330.83026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCCN2CCSCC2)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCCN2CCSCC2)Cl)N

InChI

InChI=1S/C14H19ClN2O3S/c1-19-13-9-12(16)11(15)8-10(13)14(18)20-5-2-17-3-6-21-7-4-17/h8-9H,2-7,16H2,1H3