N-(3-azanylpropyl)-N-[[3-(3,3-dimethylbutanoylamino)phenyl]methyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[[3-(3,3-dimethylbutanoylamino)phenyl]methyl]-3,4-dimethoxy-benzamide Openeye Name: N-(3-aminopropyl)-N-[[3-(3,3-dimethylbutanoylamino)phenyl]methyl]-3,4-dimethoxy-benzamide CAS Name: N-(3-aminopropyl)-N-[[3-[(3,3-dimethyl-1-oxobutyl)amino]phenyl]methyl]-3,4-dimethoxybenzamide IUPAC Name: N-(3-aminopropyl)-N-[[3-(3,3-dimethylbutanoylamino)phenyl]methyl]-3,4-dimethoxybenzamide Traditional Name: N-(3-aminopropyl)-N-[3-(3,3-dimethylbutanoylamino)benzyl]-3,4-dimethoxy-benzamide Formula: C25H35N3O4 MolecularWeight: 441.5631

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=CC=CC(=C1)CN(CCCN)C(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)(C)CC(=O)NC1=CC=CC(=C1)CN(CCCN)C(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C25H35N3O4/c1-25(2,3)16-23(29)27-20-9-6-8-18(14-20)17-28(13-7-12-26)24(30)19-10-11-21(31-4)22(15-19)32-5/h6,8-11,14-15H,7,12-13,16-17,26H2,1-5H3,(H,27,29)