N-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-3,4-dimethoxy-benzamide; ethanedioate

Systemtic Name: N-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-3,4-dimethoxy-benzamide; ethanedioate Openeye Name: N-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-3,4-dimethoxy-benzamide; oxalate CAS Name: N-[4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-3,4-dimethoxybenzamide; oxalate IUPAC Name: N-[4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-3,4-dimethoxybenzamide; oxalate Traditional Name: N-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-3,4-dimethoxy-benzamide; oxalate Formula: C24H30N2O9-2 MolecularWeight: 490.503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)OC)OC)O.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CC(C)(C)NCC(COC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)OC)OC)O.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C22H30N2O5.C2H2O4/c1-22(2,3)23-13-17(25)14-29-18-9-7-16(8-10-18)24-21(26)15-6-11-19(27-4)20(12-15)28-5;3-1(4)2(5)6/h6-12,17,23,25H,13-14H2,1-5H3,(H,24,26);(H,3,4)(H,5,6)/p-2