1-[5-methoxy-6-[[(2-phenylpiperidin-3-yl)amino]methyl]-2,3-dihydroindol-1-yl]heptan-1-one

Systemtic Name: 1-[5-methoxy-6-[[(2-phenylpiperidin-3-yl)amino]methyl]-2,3-dihydroindol-1-yl]heptan-1-one Openeye Name: 1-[5-methoxy-6-[[(2-phenyl-3-piperidyl)amino]methyl]indolin-1-yl]heptan-1-one CAS Name: 1-[5-methoxy-6-[[(2-phenyl-3-piperidinyl)amino]methyl]-2,3-dihydroindol-1-yl]-1-heptanone IUPAC Name: 1-[5-methoxy-6-[[(2-phenylpiperidin-3-yl)amino]methyl]-2,3-dihydroindol-1-yl]heptan-1-one Traditional Name: 1-[5-methoxy-6-[[(2-phenyl-3-piperidyl)amino]methyl]indolin-1-yl]heptan-1-one Formula: C28H39N3O2 MolecularWeight: 449.62816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N1CCC2=CC(=C(C=C21)CNC3CCCNC3C4=CC=CC=C4)OC

Isomeric SMILES

CCCCCCC(=O)N1CCC2=CC(=C(C=C21)CNC3CCCNC3C4=CC=CC=C4)OC

InChI

InChI=1S/C28H39N3O2/c1-3-4-5-9-14-27(32)31-17-15-22-19-26(33-2)23(18-25(22)31)20-30-24-13-10-16-29-28(24)21-11-7-6-8-12-21/h6-8,11-12,18-19,24,28-30H,3-5,9-10,13-17,20H2,1-2H3