2-chloranyl-N-[3-oxidanylidene-3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]propyl]benzamide

Systemtic Name: 2-chloranyl-N-[3-oxidanylidene-3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]propyl]benzamide Openeye Name: 2-chloro-N-[3-[4-[(4-isopropylphenyl)methyl]piperazin-4-ium-1-yl]-3-oxo-propyl]benzamide CAS Name: 2-chloro-N-[3-oxo-3-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazin-4-iumyl]propyl]benzamide IUPAC Name: 2-chloro-N-[3-oxo-3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]propyl]benzamide Traditional Name: 2-chloro-N-[3-[4-(4-isopropylbenzyl)piperazin-4-ium-1-yl]-3-keto-propyl]benzamide Formula: C24H31ClN3O2+ MolecularWeight: 428.97484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)CCNC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)CCNC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C24H30ClN3O2/c1-18(2)20-9-7-19(8-10-20)17-27-13-15-28(16-14-27)23(29)11-12-26-24(30)21-5-3-4-6-22(21)25/h3-10,18H,11-17H2,1-2H3,(H,26,30)/p+1