4-butyl-N-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]benzamide

Systemtic Name: 4-butyl-N-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]benzamide Openeye Name: 4-butyl-N-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 4-butyl-N-[4-[4-(2-ethyl-1-oxobutyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: 4-butyl-N-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 4-butyl-N-[4-[4-(2-ethylbutanoyl)piperazino]phenyl]benzamide Formula: C27H37N3O2 MolecularWeight: 435.60158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C(CC)CC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C(CC)CC

InChI

InChI=1S/C27H37N3O2/c1-4-7-8-21-9-11-23(12-10-21)26(31)28-24-13-15-25(16-14-24)29-17-19-30(20-18-29)27(32)22(5-2)6-3/h9-16,22H,4-8,17-20H2,1-3H3,(H,28,31)