[3-(azepan-1-ylsulfonyl)phenyl]-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone

Systemtic Name: [3-(azepan-1-ylsulfonyl)phenyl]-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone Openeye Name: [3-(azepan-1-ylsulfonyl)phenyl]-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone CAS Name: [3-(1-azepanylsulfonyl)phenyl]-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone IUPAC Name: [3-(azepan-1-ylsulfonyl)phenyl]-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone Traditional Name: [3-(azepan-1-ylsulfonyl)phenyl]-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone Formula: C23H28N2O3S MolecularWeight: 412.54502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(CCC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)N(CCC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H28N2O3S/c1-18-11-12-22-19(16-18)9-7-15-25(22)23(26)20-8-6-10-21(17-20)29(27,28)24-13-4-2-3-5-14-24/h6,8,10-12,16-17H,2-5,7,9,13-15H2,1H3