(2S)-3-(2-methoxyethoxy)-2-[[3-[(2,4,6-trimethylphenyl)carbamoylamino]naphthalen-2-yl]carbonylamino]propanoic acid

Systemtic Name: (2S)-3-(2-methoxyethoxy)-2-[[3-[(2,4,6-trimethylphenyl)carbamoylamino]naphthalen-2-yl]carbonylamino]propanoic acid Openeye Name: (2S)-3-(2-methoxyethoxy)-2-[[3-[(2,4,6-trimethylphenyl)carbamoylamino]naphthalene-2-carbonyl]amino]propanoic acid CAS Name: (2S)-3-(2-methoxyethoxy)-2-[[oxo-[3-[[oxo-(2,4,6-trimethylanilino)methyl]amino]-2-naphthalenyl]methyl]amino]propanoic acid IUPAC Name: (2S)-3-(2-methoxyethoxy)-2-[[3-[(2,4,6-trimethylphenyl)carbamoylamino]naphthalene-2-carbonyl]amino]propanoic acid Traditional Name: (2S)-2-[[3-(mesitylcarbamoylamino)-2-naphthoyl]amino]-3-(2-methoxyethoxy)propionic acid Formula: C27H31N3O6 MolecularWeight: 493.55154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)NC2=CC3=CC=CC=C3C=C2C(=O)NC(COCCOC)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)NC2=CC3=CC=CC=C3C=C2C(=O)N[C@@H](COCCOC)C(=O)O)C

InChI

InChI=1S/C27H31N3O6/c1-16-11-17(2)24(18(3)12-16)30-27(34)29-22-14-20-8-6-5-7-19(20)13-21(22)25(31)28-23(26(32)33)15-36-10-9-35-4/h5-8,11-14,23H,9-10,15H2,1-4H3,(H,28,31)(H,32,33)(H2,29,30,34)/t23-/m0/s1