1-[3-(1-hexyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]propan-1-one; octanedioic acid

Systemtic Name: 1-[3-(1-hexyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]propan-1-one; octanedioic acid Openeye Name: 1-[3-(1-hexyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]propan-1-one; octanedioic acid CAS Name: 1-[3-(1-hexyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]-1-propanone; octanedioic acid IUPAC Name: 1-[3-(1-hexyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]propan-1-one; octanedioic acid Traditional Name: 1-[3-(1-hexyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]propan-1-one; suberic acid Formula: C30H44N2O5 MolecularWeight: 512.68076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CCC(=CC1)C2=CNC3=C2C=C(C=C3)C(=O)CC.C(CCCC(=O)O)CCC(=O)O

Isomeric SMILES

CCCCCCN1CCC(=CC1)C2=CNC3=C2C=C(C=C3)C(=O)CC.C(CCCC(=O)O)CCC(=O)O

InChI

InChI=1S/C22H30N2O.C8H14O4/c1-3-5-6-7-12-24-13-10-17(11-14-24)20-16-23-21-9-8-18(15-19(20)21)22(25)4-2;9-7(10)5-3-1-2-4-6-8(11)12/h8-10,15-16,23H,3-7,11-14H2,1-2H3;1-6H2,(H,9,10)(H,11,12)