1-methylsulfonyl-N-[(1S)-1-phenylbutyl]-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: 1-methylsulfonyl-N-[(1S)-1-phenylbutyl]-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: 1-methylsulfonyl-N-[(1S)-1-phenylbutyl]-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: 1-methylsulfonyl-N-[(1S)-1-phenylbutyl]-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: 1-methylsulfonyl-N-[(1S)-1-phenylbutyl]-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: 1-mesyl-N-[(1S)-1-phenylbutyl]-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

Isomeric SMILES

CCC[C@@H](C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

InChI

InChI=1S/C21H26N2O3S/c1-3-8-19(16-9-5-4-6-10-16)22-21(24)18-12-13-20-17(15-18)11-7-14-23(20)27(2,25)26/h4-6,9-10,12-13,15,19H,3,7-8,11,14H2,1-2H3,(H,22,24)/t19-/m0/s1