N-(3-azanylpentanoyl)-N'-(2-dimethylaminoethyl)-N'-methyl-2-phenethyl-butanediamide

Systemtic Name: N-(3-azanylpentanoyl)-N'-(2-dimethylaminoethyl)-N'-methyl-2-phenethyl-butanediamide Openeye Name: N-(3-aminopentanoyl)-N'-(2-dimethylaminoethyl)-N'-methyl-2-phenethyl-butanediamide CAS Name: N-(3-amino-1-oxopentyl)-N'-(2-dimethylaminoethyl)-N'-methyl-2-phenethylbutanediamide IUPAC Name: N-(3-aminopentanoyl)-N'-(2-dimethylaminoethyl)-N'-methyl-2-phenethylbutanediamide Traditional Name: N-(3-aminopentanoyl)-N'-(2-dimethylaminoethyl)-N'-methyl-2-phenethyl-succinamide Formula: C22H36N4O3 MolecularWeight: 404.54624

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)NC(=O)C(CCC1=CC=CC=C1)CC(=O)N(C)CCN(C)C)N

Isomeric SMILES

CCC(CC(=O)NC(=O)C(CCC1=CC=CC=C1)CC(=O)N(C)CCN(C)C)N

InChI

InChI=1S/C22H36N4O3/c1-5-19(23)16-20(27)24-22(29)18(12-11-17-9-7-6-8-10-17)15-21(28)26(4)14-13-25(2)3/h6-10,18-19H,5,11-16,23H2,1-4H3,(H,24,27,29)