[(1S)-2-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]amino]-2-oxidanylidene-1-phenyl-ethyl]azanium

Systemtic Name: [(1S)-2-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]amino]-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: [(1S)-2-[4-(4-methylpiperazin-4-ium-1-yl)anilino]-2-oxo-1-phenyl-ethyl]ammonium CAS Name: [(1S)-2-[4-(4-methyl-1-piperazin-4-iumyl)anilino]-2-oxo-1-phenylethyl]ammonium IUPAC Name: [(1S)-2-[4-(4-methylpiperazin-4-ium-1-yl)anilino]-2-oxo-1-phenylethyl]azanium Traditional Name: [(1S)-2-keto-2-[4-(4-methylpiperazin-4-ium-1-yl)anilino]-1-phenyl-ethyl]ammonium Formula: C19H26N4O+2 MolecularWeight: 326.43594

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C(C3=CC=CC=C3)[NH3+]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)[C@H](C3=CC=CC=C3)[NH3+]

InChI

InChI=1S/C19H24N4O/c1-22-11-13-23(14-12-22)17-9-7-16(8-10-17)21-19(24)18(20)15-5-3-2-4-6-15/h2-10,18H,11-14,20H2,1H3,(H,21,24)/p+2/t18-/m0/s1