hexanedioic acid; methyl 2-[5-[3-(tert-butylamino)-2-oxidanyl-propoxy]-1H-indol-3-yl]ethanoate

Systemtic Name: hexanedioic acid; methyl 2-[5-[3-(tert-butylamino)-2-oxidanyl-propoxy]-1H-indol-3-yl]ethanoate Openeye Name: adipic acid; methyl 2-[5-[3-(tert-butylamino)-2-hydroxy-propoxy]-1H-indol-3-yl]acetate CAS Name: 2-[5-[3-(tert-butylamino)-2-hydroxypropoxy]-1H-indol-3-yl]acetic acid methyl ester; hexanedioic acid IUPAC Name: hexanedioic acid; methyl 2-[5-[3-(tert-butylamino)-2-hydroxypropoxy]-1H-indol-3-yl]acetate Traditional Name: adipic acid; 2-[5-[3-(tert-butylamino)-2-hydroxy-propoxy]-1H-indol-3-yl]acetic acid methyl ester Formula: C24H36N2O8 MolecularWeight: 480.55124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC2=C(C=C1)NC=C2CC(=O)OC)O.C(CCC(=O)O)CC(=O)O

Isomeric SMILES

CC(C)(C)NCC(COC1=CC2=C(C=C1)NC=C2CC(=O)OC)O.C(CCC(=O)O)CC(=O)O

InChI

InChI=1S/C18H26N2O4.C6H10O4/c1-18(2,3)20-10-13(21)11-24-14-5-6-16-15(8-14)12(9-19-16)7-17(22)23-4;7-5(8)3-1-2-4-6(9)10/h5-6,8-9,13,19-21H,7,10-11H2,1-4H3;1-4H2,(H,7,8)(H,9,10)