methyl 3-(1-benzothiophen-3-yl)-2-[(phenylmethyl)amino]propanoate

Systemtic Name: methyl 3-(1-benzothiophen-3-yl)-2-[(phenylmethyl)amino]propanoate Openeye Name: methyl 3-(benzothiophen-3-yl)-2-(benzylamino)propanoate CAS Name: 3-(1-benzothiophen-3-yl)-2-[(phenylmethyl)amino]propanoic acid methyl ester IUPAC Name: methyl 3-(1-benzothiophen-3-yl)-2-(benzylamino)propanoate Traditional Name: 3-(benzothiophen-3-yl)-2-(benzylamino)propionic acid methyl ester Formula: C19H19NO2S MolecularWeight: 325.42466

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CSC2=CC=CC=C21)NCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C(CC1=CSC2=CC=CC=C21)NCC3=CC=CC=C3

InChI

InChI=1S/C19H19NO2S/c1-22-19(21)17(20-12-14-7-3-2-4-8-14)11-15-13-23-18-10-6-5-9-16(15)18/h2-10,13,17,20H,11-12H2,1H3