methyl 2-[[1-[3-(pyridin-2-ylamino)propoxy]indol-2-yl]methyl]octanoate

Systemtic Name: methyl 2-[[1-[3-(pyridin-2-ylamino)propoxy]indol-2-yl]methyl]octanoate Openeye Name: methyl 2-[[1-[3-(2-pyridylamino)propoxy]indol-2-yl]methyl]octanoate CAS Name: 2-[[1-[3-(2-pyridinylamino)propoxy]-2-indolyl]methyl]octanoic acid methyl ester IUPAC Name: methyl 2-[[1-[3-(pyridin-2-ylamino)propoxy]indol-2-yl]methyl]octanoate Traditional Name: 2-[[1-[3-(2-pyridylamino)propoxy]indol-2-yl]methyl]caprylic acid methyl ester Formula: C26H35N3O3 MolecularWeight: 437.5744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC1=CC2=CC=CC=C2N1OCCCNC3=CC=CC=N3)C(=O)OC

Isomeric SMILES

CCCCCCC(CC1=CC2=CC=CC=C2N1OCCCNC3=CC=CC=N3)C(=O)OC

InChI

InChI=1S/C26H35N3O3/c1-3-4-5-6-13-22(26(30)31-2)20-23-19-21-12-7-8-14-24(21)29(23)32-18-11-17-28-25-15-9-10-16-27-25/h7-10,12,14-16,19,22H,3-6,11,13,17-18,20H2,1-2H3,(H,27,28)