N-[(2R)-1-(dipentylamino)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]quinoline-2-carboxamide

Systemtic Name: N-[(2R)-1-(dipentylamino)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]quinoline-2-carboxamide Openeye Name: N-[(1R)-2-(dipentylamino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]quinoline-2-carboxamide CAS Name: N-[(2R)-1-(dipentylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-quinolinecarboxamide IUPAC Name: N-[(2R)-1-(dipentylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]quinoline-2-carboxamide Traditional Name: N-[(1R)-2-(diamylamino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]quinaldamide Formula: C31H38N4O2 MolecularWeight: 498.65902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CCCCCN(CCCCC)C(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C31H38N4O2/c1-3-5-11-19-35(20-12-6-4-2)31(37)29(21-24-22-32-27-16-10-8-14-25(24)27)34-30(36)28-18-17-23-13-7-9-15-26(23)33-28/h7-10,13-18,22,29,32H,3-6,11-12,19-21H2,1-2H3,(H,34,36)/t29-/m1/s1