2-(4-azanylbutanoyl)-3,3a,4,5-tetrahydro-2H-thieno[3,2-d]quinoline-3-carboxylic acid

Systemtic Name: 2-(4-azanylbutanoyl)-3,3a,4,5-tetrahydro-2H-thieno[3,2-d]quinoline-3-carboxylic acid Openeye Name: 2-(4-aminobutanoyl)-3,3a,4,5-tetrahydro-2H-thieno[3,2-d]quinoline-3-carboxylic acid CAS Name: 2-(4-amino-1-oxobutyl)-3,3a,4,5-tetrahydro-2H-thieno[3,2-d]quinoline-3-carboxylic acid IUPAC Name: 2-(4-aminobutanoyl)-3,3a,4,5-tetrahydro-2H-thieno[3,2-d]quinoline-3-carboxylic acid Traditional Name: 2-(4-aminobutanoyl)-3,3a,4,5-tetrahydro-2H-thieno[3,2-d]quinoline-3-carboxylic acid Formula: C16H20N2O3S MolecularWeight: 320.4066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN=C2C=CC=CC23C1C(C(S3)C(=O)CCCN)C(=O)O

Isomeric SMILES

C1CN=C2C=CC=CC23C1C(C(S3)C(=O)CCCN)C(=O)O

InChI

InChI=1S/C16H20N2O3S/c17-8-3-4-11(19)14-13(15(20)21)10-6-9-18-12-5-1-2-7-16(10,12)22-14/h1-2,5,7,10,13-14H,3-4,6,8-9,17H2,(H,20,21)