5-(2-ethylhexanoylamino)-N-(3-methoxypropyl)-2-[4-(phenylmethyl)piperazin-1-yl]benzamide

Systemtic Name: 5-(2-ethylhexanoylamino)-N-(3-methoxypropyl)-2-[4-(phenylmethyl)piperazin-1-yl]benzamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-5-(2-ethylhexanoylamino)-N-(3-methoxypropyl)benzamide CAS Name: 5-[(2-ethyl-1-oxohexyl)amino]-N-(3-methoxypropyl)-2-[4-(phenylmethyl)-1-piperazinyl]benzamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-5-(2-ethylhexanoylamino)-N-(3-methoxypropyl)benzamide Traditional Name: 2-(4-benzylpiperazino)-5-(2-ethylhexanoylamino)-N-(3-methoxypropyl)benzamide Formula: C30H44N4O3 MolecularWeight: 508.69536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3)C(=O)NCCCOC

Isomeric SMILES

CCCCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3)C(=O)NCCCOC

InChI

InChI=1S/C30H44N4O3/c1-4-6-13-25(5-2)29(35)32-26-14-15-28(27(22-26)30(36)31-16-10-21-37-3)34-19-17-33(18-20-34)23-24-11-8-7-9-12-24/h7-9,11-12,14-15,22,25H,4-6,10,13,16-21,23H2,1-3H3,(H,31,36)(H,32,35)