dimethyl-[(2S)-2-[2-[(3-methylphenyl)carbonylamino]ethanoylamino]-2-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(2S)-2-[2-[(3-methylphenyl)carbonylamino]ethanoylamino]-2-phenyl-ethyl]azanium Openeye Name: dimethyl-[(2S)-2-[[2-[(3-methylbenzoyl)amino]acetyl]amino]-2-phenyl-ethyl]ammonium CAS Name: dimethyl-[(2S)-2-[[2-[[(3-methylphenyl)-oxomethyl]amino]-1-oxoethyl]amino]-2-phenylethyl]ammonium IUPAC Name: dimethyl-[(2S)-2-[[2-[(3-methylbenzoyl)amino]acetyl]amino]-2-phenylethyl]azanium Traditional Name: dimethyl-[(2S)-2-[[2-(m-toluoylamino)acetyl]amino]-2-phenyl-ethyl]ammonium Formula: C20H26N3O2+ MolecularWeight: 340.43934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O2/c1-15-8-7-11-17(12-15)20(25)21-13-19(24)22-18(14-23(2)3)16-9-5-4-6-10-16/h4-12,18H,13-14H2,1-3H3,(H,21,25)(H,22,24)/p+1/t18-/m1/s1