N-[1-[3-[4-(aminomethyl)phenyl]propanoyl]-3,4-dihydro-2H-quinolin-6-yl]-N-methyl-benzenesulfonamide

Systemtic Name: N-[1-[3-[4-(aminomethyl)phenyl]propanoyl]-3,4-dihydro-2H-quinolin-6-yl]-N-methyl-benzenesulfonamide Openeye Name: N-[1-[3-[4-(aminomethyl)phenyl]propanoyl]-3,4-dihydro-2H-quinolin-6-yl]-N-methyl-benzenesulfonamide CAS Name: N-[1-[3-[4-(aminomethyl)phenyl]-1-oxopropyl]-3,4-dihydro-2H-quinolin-6-yl]-N-methylbenzenesulfonamide IUPAC Name: N-[1-[3-[4-(aminomethyl)phenyl]propanoyl]-3,4-dihydro-2H-quinolin-6-yl]-N-methylbenzenesulfonamide Traditional Name: N-[1-[3-[4-(aminomethyl)phenyl]propanoyl]-3,4-dihydro-2H-quinolin-6-yl]-N-methyl-benzenesulfonamide Formula: C26H29N3O3S MolecularWeight: 463.59176

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC2=C(C=C1)N(CCC2)C(=O)CCC3=CC=C(C=C3)CN)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN(C1=CC2=C(C=C1)N(CCC2)C(=O)CCC3=CC=C(C=C3)CN)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H29N3O3S/c1-28(33(31,32)24-7-3-2-4-8-24)23-14-15-25-22(18-23)6-5-17-29(25)26(30)16-13-20-9-11-21(19-27)12-10-20/h2-4,7-12,14-15,18H,5-6,13,16-17,19,27H2,1H3