N-(2-azanylethyl)-4-(3,4-dimethylphenoxy)-3-(3-phenylpropanoylamino)benzamide

Systemtic Name: N-(2-azanylethyl)-4-(3,4-dimethylphenoxy)-3-(3-phenylpropanoylamino)benzamide Openeye Name: N-(2-aminoethyl)-4-(3,4-dimethylphenoxy)-3-(3-phenylpropanoylamino)benzamide CAS Name: N-(2-aminoethyl)-4-(3,4-dimethylphenoxy)-3-[(1-oxo-3-phenylpropyl)amino]benzamide IUPAC Name: N-(2-aminoethyl)-4-(3,4-dimethylphenoxy)-3-(3-phenylpropanoylamino)benzamide Traditional Name: N-(2-aminoethyl)-4-(3,4-dimethylphenoxy)-3-(hydrocinnamoylamino)benzamide Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC2=C(C=C(C=C2)C(=O)NCCN)NC(=O)CCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC2=C(C=C(C=C2)C(=O)NCCN)NC(=O)CCC3=CC=CC=C3)C

InChI

InChI=1S/C26H29N3O3/c1-18-8-11-22(16-19(18)2)32-24-12-10-21(26(31)28-15-14-27)17-23(24)29-25(30)13-9-20-6-4-3-5-7-20/h3-8,10-12,16-17H,9,13-15,27H2,1-2H3,(H,28,31)(H,29,30)