N-[(1S)-1-cyclohexylethyl]-3-[[3-(diethylamino)propyl-methyl-amino]methyl]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[(1S)-1-cyclohexylethyl]-3-[[3-(diethylamino)propyl-methyl-amino]methyl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[(1S)-1-cyclohexylethyl]-3-[[3-(diethylamino)propyl-methyl-amino]methyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[(1S)-1-cyclohexylethyl]-3-[[3-(diethylamino)propyl-methylamino]methyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[(1S)-1-cyclohexylethyl]-3-[[3-(diethylamino)propyl-methylamino]methyl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[(1S)-1-cyclohexylethyl]-3-[[3-(diethylamino)propyl-methyl-amino]methyl]-2-phenyl-cinchoninamide Formula: C33H46N4O MolecularWeight: 514.74454

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCN(C)CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)NC(C)C4CCCCC4

Isomeric SMILES

CCN(CC)CCCN(C)CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)N[C@@H](C)C4CCCCC4

InChI

InChI=1S/C33H46N4O/c1-5-37(6-2)23-15-22-36(4)24-29-31(33(38)34-25(3)26-16-9-7-10-17-26)28-20-13-14-21-30(28)35-32(29)27-18-11-8-12-19-27/h8,11-14,18-21,25-26H,5-7,9-10,15-17,22-24H2,1-4H3,(H,34,38)/t25-/m0/s1