N-(3-azanylpropyl)-N-[[2-chloranyl-5-(2-phenylethanoylamino)phenyl]methyl]-4-methoxy-benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[[2-chloranyl-5-(2-phenylethanoylamino)phenyl]methyl]-4-methoxy-benzamide Openeye Name: N-(3-aminopropyl)-N-[[2-chloro-5-[(2-phenylacetyl)amino]phenyl]methyl]-4-methoxy-benzamide CAS Name: N-(3-aminopropyl)-N-[[2-chloro-5-[(1-oxo-2-phenylethyl)amino]phenyl]methyl]-4-methoxybenzamide IUPAC Name: N-(3-aminopropyl)-N-[[2-chloro-5-[(2-phenylacetyl)amino]phenyl]methyl]-4-methoxybenzamide Traditional Name: N-(3-aminopropyl)-N-[2-chloro-5-[(2-phenylacetyl)amino]benzyl]-4-methoxy-benzamide Formula: C26H28ClN3O3 MolecularWeight: 465.97182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(CCCN)CC2=C(C=CC(=C2)NC(=O)CC3=CC=CC=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(CCCN)CC2=C(C=CC(=C2)NC(=O)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C26H28ClN3O3/c1-33-23-11-8-20(9-12-23)26(32)30(15-5-14-28)18-21-17-22(10-13-24(21)27)29-25(31)16-19-6-3-2-4-7-19/h2-4,6-13,17H,5,14-16,18,28H2,1H3,(H,29,31)