methyl 4-azanyl-5-chloranyl-2-methoxy-3-(3-oxidanylpropyl)benzoate

Systemtic Name: methyl 4-azanyl-5-chloranyl-2-methoxy-3-(3-oxidanylpropyl)benzoate Openeye Name: methyl 4-amino-5-chloro-3-(3-hydroxypropyl)-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-3-(3-hydroxypropyl)-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-amino-5-chloro-3-(3-hydroxypropyl)-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-3-(3-hydroxypropyl)-2-methoxy-benzoic acid methyl ester Formula: C12H16ClNO4 MolecularWeight: 273.71274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1C(=O)OC)Cl)N)CCCO

Isomeric SMILES

COC1=C(C(=C(C=C1C(=O)OC)Cl)N)CCCO

InChI

InChI=1S/C12H16ClNO4/c1-17-11-7(4-3-5-15)10(14)9(13)6-8(11)12(16)18-2/h6,15H,3-5,14H2,1-2H3