N-[(5-acetamido-2-chloranyl-phenyl)methyl]-N-(3-azanylpropyl)-3,4-dimethoxy-benzamide

Systemtic Name: N-[(5-acetamido-2-chloranyl-phenyl)methyl]-N-(3-azanylpropyl)-3,4-dimethoxy-benzamide Openeye Name: N-[(5-acetamido-2-chloro-phenyl)methyl]-N-(3-aminopropyl)-3,4-dimethoxy-benzamide CAS Name: N-[(5-acetamido-2-chlorophenyl)methyl]-N-(3-aminopropyl)-3,4-dimethoxybenzamide IUPAC Name: N-[(5-acetamido-2-chlorophenyl)methyl]-N-(3-aminopropyl)-3,4-dimethoxybenzamide Traditional Name: N-(5-acetamido-2-chloro-benzyl)-N-(3-aminopropyl)-3,4-dimethoxy-benzamide Formula: C21H26ClN3O4 MolecularWeight: 419.90184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClN3O4/c1-14(26)24-17-6-7-18(22)16(11-17)13-25(10-4-9-23)21(27)15-5-8-19(28-2)20(12-15)29-3/h5-8,11-12H,4,9-10,13,23H2,1-3H3,(H,24,26)