(3-chloranyl-1-benzothiophen-2-yl)methyl 2-[(3,4-dimethoxyphenyl)carbonylamino]ethanoate

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)methyl 2-[(3,4-dimethoxyphenyl)carbonylamino]ethanoate Openeye Name: (3-chlorobenzothiophen-2-yl)methyl 2-[(3,4-dimethoxybenzoyl)amino]acetate CAS Name: 2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]acetic acid (3-chloro-1-benzothiophen-2-yl)methyl ester IUPAC Name: (3-chloro-1-benzothiophen-2-yl)methyl 2-[(3,4-dimethoxybenzoyl)amino]acetate Traditional Name: 2-(veratroylamino)acetic acid (3-chlorobenzothiophen-2-yl)methyl ester Formula: C20H18ClNO5S MolecularWeight: 419.87862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=C(C3=CC=CC=C3S2)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=C(C3=CC=CC=C3S2)Cl)OC

InChI

InChI=1S/C20H18ClNO5S/c1-25-14-8-7-12(9-15(14)26-2)20(24)22-10-18(23)27-11-17-19(21)13-5-3-4-6-16(13)28-17/h3-9H,10-11H2,1-2H3,(H,22,24)