2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]ethyl 4-(dimethylamino)benzoate

Systemtic Name: 2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]ethyl 4-(dimethylamino)benzoate Openeye Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]ethyl 4-(dimethylamino)benzoate CAS Name: 4-(dimethylamino)benzoic acid 2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]ethyl ester IUPAC Name: 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]ethyl 4-(dimethylamino)benzoate Traditional Name: 4-(dimethylamino)benzoic acid 2-[(3-chlorobenzothiophene-2-carbonyl)amino]ethyl ester Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)OCCNC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)OCCNC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C20H19ClN2O3S/c1-23(2)14-9-7-13(8-10-14)20(25)26-12-11-22-19(24)18-17(21)15-5-3-4-6-16(15)27-18/h3-10H,11-12H2,1-2H3,(H,22,24)