methyl-[2-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-(2-oxidanylidene-2-phenylazanyl-ethyl)azanium

Systemtic Name: methyl-[2-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-(2-oxidanylidene-2-phenylazanyl-ethyl)azanium Openeye Name: (2-anilino-2-oxo-ethyl)-methyl-[2-[4-(m-tolylmethyl)piperazin-4-ium-1-yl]-2-oxo-ethyl]ammonium CAS Name: (2-anilino-2-oxoethyl)-methyl-[2-[4-[(3-methylphenyl)methyl]-1-piperazin-4-iumyl]-2-oxoethyl]ammonium IUPAC Name: (2-anilino-2-oxoethyl)-methyl-[2-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]-2-oxoethyl]azanium Traditional Name: (2-anilino-2-keto-ethyl)-[2-keto-2-[4-(3-methylbenzyl)piperazin-4-ium-1-yl]ethyl]-methyl-ammonium Formula: C23H32N4O2+2 MolecularWeight: 396.52578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=O)C[NH+](C)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=O)C[NH+](C)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H30N4O2/c1-19-7-6-8-20(15-19)16-26-11-13-27(14-12-26)23(29)18-25(2)17-22(28)24-21-9-4-3-5-10-21/h3-10,15H,11-14,16-18H2,1-2H3,(H,24,28)/p+2