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

Systemtic Name: N-(3-ethoxypropyl)-5-(2-ethylhexanoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Openeye Name: N-(3-ethoxypropyl)-5-(2-ethylhexanoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide CAS Name: N-(3-ethoxypropyl)-5-[(2-ethyl-1-oxohexyl)amino]-2-[4-(2-methoxyphenyl)-1-piperazinyl]benzamide IUPAC Name: N-(3-ethoxypropyl)-5-(2-ethylhexanoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Traditional Name: N-(3-ethoxypropyl)-5-(2-ethylhexanoylamino)-2-[4-(2-methoxyphenyl)piperazino]benzamide Formula: C31H46N4O4 MolecularWeight: 538.72134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCCCOCC

Isomeric SMILES

CCCCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCCCOCC

InChI

InChI=1S/C31H46N4O4/c1-5-8-12-24(6-2)30(36)33-25-15-16-27(26(23-25)31(37)32-17-11-22-39-7-3)34-18-20-35(21-19-34)28-13-9-10-14-29(28)38-4/h9-10,13-16,23-24H,5-8,11-12,17-22H2,1-4H3,(H,32,37)(H,33,36)