(2,2-dimethyl-3,4-dihydrochromen-4-yl) 3-azanyl-1-benzothiophene-2-carboxylate

Systemtic Name: (2,2-dimethyl-3,4-dihydrochromen-4-yl) 3-azanyl-1-benzothiophene-2-carboxylate Openeye Name: (2,2-dimethylchroman-4-yl) 3-aminobenzothiophene-2-carboxylate CAS Name: 3-amino-1-benzothiophene-2-carboxylic acid (2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl) ester IUPAC Name: (2,2-dimethyl-3,4-dihydrochromen-4-yl) 3-amino-1-benzothiophene-2-carboxylate Traditional Name: 3-aminobenzothiophene-2-carboxylic acid (2,2-dimethylchroman-4-yl) ester Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=CC=CC=C2O1)OC(=O)C3=C(C4=CC=CC=C4S3)N)C

Isomeric SMILES

CC1(CC(C2=CC=CC=C2O1)OC(=O)C3=C(C4=CC=CC=C4S3)N)C

InChI

InChI=1S/C20H19NO3S/c1-20(2)11-15(12-7-3-5-9-14(12)24-20)23-19(22)18-17(21)13-8-4-6-10-16(13)25-18/h3-10,15H,11,21H2,1-2H3