4-chloranyl-N-[2-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)ethyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[2-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)ethyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)ethyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[2-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)ethyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[2-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)ethyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)ethyl]-3-nitro-benzamide Formula: C18H18ClN3O5S MolecularWeight: 423.87062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)S(=O)(=O)CCNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)S(=O)(=O)CCNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H18ClN3O5S/c19-15-8-7-14(12-17(15)22(24)25)18(23)20-9-11-28(26,27)21-10-3-5-13-4-1-2-6-16(13)21/h1-2,4,6-8,12H,3,5,9-11H2,(H,20,23)