5-[(5-chloranyl-1-benzothiophen-3-yl)methylamino]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[(5-chloranyl-1-benzothiophen-3-yl)methylamino]-5-oxidanylidene-pentanoate Openeye Name: 5-[(5-chlorobenzothiophen-3-yl)methylamino]-5-oxo-pentanoate CAS Name: 5-[(5-chloro-1-benzothiophen-3-yl)methylamino]-5-oxopentanoate IUPAC Name: 5-[(5-chloro-1-benzothiophen-3-yl)methylamino]-5-oxopentanoate Traditional Name: 5-[(5-chlorobenzothiophen-3-yl)methylamino]-5-keto-valerate Formula: C14H13ClNO3S- MolecularWeight: 310.77592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C(=CS2)CNC(=O)CCCC(=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1Cl)C(=CS2)CNC(=O)CCCC(=O)[O-]

InChI

InChI=1S/C14H14ClNO3S/c15-10-4-5-12-11(6-10)9(8-20-12)7-16-13(17)2-1-3-14(18)19/h4-6,8H,1-3,7H2,(H,16,17)(H,18,19)/p-1