dimethyl-[(2S)-2-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]-2-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(2S)-2-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]-2-phenyl-ethyl]azanium Openeye Name: dimethyl-[(2S)-2-[[4-methyl-3-(1-piperidylsulfonyl)benzoyl]amino]-2-phenyl-ethyl]ammonium CAS Name: dimethyl-[(2S)-2-[[[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]-2-phenylethyl]ammonium IUPAC Name: dimethyl-[(2S)-2-[(4-methyl-3-piperidin-1-ylsulfonylbenzoyl)amino]-2-phenylethyl]azanium Traditional Name: dimethyl-[(2S)-2-[(4-methyl-3-piperidinosulfonyl-benzoyl)amino]-2-phenyl-ethyl]ammonium Formula: C23H32N3O3S+ MolecularWeight: 430.58348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(C[NH+](C)C)C2=CC=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N[C@H](C[NH+](C)C)C2=CC=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H31N3O3S/c1-18-12-13-20(16-22(18)30(28,29)26-14-8-5-9-15-26)23(27)24-21(17-25(2)3)19-10-6-4-7-11-19/h4,6-7,10-13,16,21H,5,8-9,14-15,17H2,1-3H3,(H,24,27)/p+1/t21-/m1/s1