N-(4-octylphenyl)-2-[4-[2-[(4-octylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(4-octylphenyl)-2-[4-[2-[(4-octylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]ethanamide Openeye Name: 2-[4-[2-(4-octylanilino)-2-oxo-ethyl]piperazin-1-yl]-N-(4-octylphenyl)acetamide CAS Name: 2-[4-[2-(4-octylanilino)-2-oxoethyl]-1-piperazinyl]-N-(4-octylphenyl)acetamide IUPAC Name: 2-[4-[2-(4-octylanilino)-2-oxoethyl]piperazin-1-yl]-N-(4-octylphenyl)acetamide Traditional Name: 2-[4-[2-keto-2-(4-octylanilino)ethyl]piperazino]-N-(4-octylphenyl)acetamide Formula: C36H56N4O2 MolecularWeight: 576.85544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)CC(=O)NC3=CC=C(C=C3)CCCCCCCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)CC(=O)NC3=CC=C(C=C3)CCCCCCCC

InChI

InChI=1S/C36H56N4O2/c1-3-5-7-9-11-13-15-31-17-21-33(22-18-31)37-35(41)29-39-25-27-40(28-26-39)30-36(42)38-34-23-19-32(20-24-34)16-14-12-10-8-6-4-2/h17-24H,3-16,25-30H2,1-2H3,(H,37,41)(H,38,42)