propan-2-yl 2-chloranyl-5-(pentoxycarbothioylamino)benzoate

Systemtic Name: propan-2-yl 2-chloranyl-5-(pentoxycarbothioylamino)benzoate Openeye Name: isopropyl 2-chloro-5-(pentoxycarbothioylamino)benzoate CAS Name: 2-chloro-5-[[pentoxy(sulfanylidene)methyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-chloro-5-(pentoxycarbothioylamino)benzoate Traditional Name: 5-(amoxycarbothioylamino)-2-chloro-benzoic acid isopropyl ester Formula: C16H22ClNO3S MolecularWeight: 343.86878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=S)NC1=CC(=C(C=C1)Cl)C(=O)OC(C)C

Isomeric SMILES

CCCCCOC(=S)NC1=CC(=C(C=C1)Cl)C(=O)OC(C)C

InChI

InChI=1S/C16H22ClNO3S/c1-4-5-6-9-20-16(22)18-12-7-8-14(17)13(10-12)15(19)21-11(2)3/h7-8,10-11H,4-6,9H2,1-3H3,(H,18,22)