N-(3-ethoxypropyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)benzamide

Systemtic Name: N-(3-ethoxypropyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)benzamide Openeye Name: N-(3-ethoxypropyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)benzamide CAS Name: N-(3-ethoxypropyl)-2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-[(3-methyl-1-oxobutyl)amino]benzamide IUPAC Name: N-(3-ethoxypropyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)benzamide Traditional Name: N-(3-ethoxypropyl)-5-(isovalerylamino)-2-[4-(2-methoxyphenyl)piperazino]benzamide Formula: C28H40N4O4 MolecularWeight: 496.6416

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)CC(C)C)N2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)CC(C)C)N2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C28H40N4O4/c1-5-36-18-8-13-29-28(34)23-20-22(30-27(33)19-21(2)3)11-12-24(23)31-14-16-32(17-15-31)25-9-6-7-10-26(25)35-4/h6-7,9-12,20-21H,5,8,13-19H2,1-4H3,(H,29,34)(H,30,33)