3-[3-(benzimidazol-1-yl)propylamino]-N-(2-methoxyphenyl)butanamide; ethanedioic acid

Systemtic Name: 3-[3-(benzimidazol-1-yl)propylamino]-N-(2-methoxyphenyl)butanamide; ethanedioic acid Openeye Name: 3-[3-(benzimidazol-1-yl)propylamino]-N-(2-methoxyphenyl)butanamide; oxalic acid CAS Name: 3-[3-(1-benzimidazolyl)propylamino]-N-(2-methoxyphenyl)butanamide; oxalic acid IUPAC Name: 3-[3-(benzimidazol-1-yl)propylamino]-N-(2-methoxyphenyl)butanamide; oxalic acid Traditional Name: 3-[3-(benzimidazol-1-yl)propylamino]-N-(2-methoxyphenyl)butyramide; oxalic acid Formula: C23H28N4O6 MolecularWeight: 456.49162

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC=CC=C1OC)NCCCN2C=NC3=CC=CC=C32.C(=O)(C(=O)O)O

Isomeric SMILES

CC(CC(=O)NC1=CC=CC=C1OC)NCCCN2C=NC3=CC=CC=C32.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H26N4O2.C2H2O4/c1-16(14-21(26)24-18-9-4-6-11-20(18)27-2)22-12-7-13-25-15-23-17-8-3-5-10-19(17)25;3-1(4)2(5)6/h3-6,8-11,15-16,22H,7,12-14H2,1-2H3,(H,24,26);(H,3,4)(H,5,6)