(3-chloranyl-1-benzothiophen-2-yl)methyl 3,5-diacetamidobenzoate

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)methyl 3,5-diacetamidobenzoate Openeye Name: (3-chlorobenzothiophen-2-yl)methyl 3,5-diacetamidobenzoate CAS Name: 3,5-diacetamidobenzoic acid (3-chloro-1-benzothiophen-2-yl)methyl ester IUPAC Name: (3-chloro-1-benzothiophen-2-yl)methyl 3,5-diacetamidobenzoate Traditional Name: 3,5-diacetamidobenzoic acid (3-chlorobenzothiophen-2-yl)methyl ester Formula: C20H17ClN2O4S MolecularWeight: 416.87798

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)C(=O)OCC2=C(C3=CC=CC=C3S2)Cl)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)C(=O)OCC2=C(C3=CC=CC=C3S2)Cl)NC(=O)C

InChI

InChI=1S/C20H17ClN2O4S/c1-11(24)22-14-7-13(8-15(9-14)23-12(2)25)20(26)27-10-18-19(21)16-5-3-4-6-17(16)28-18/h3-9H,10H2,1-2H3,(H,22,24)(H,23,25)