2-[[3-[(2,6-dimethylphenyl)carbamoylamino]naphthalen-2-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[3-[(2,6-dimethylphenyl)carbamoylamino]naphthalen-2-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[3-[(2,6-dimethylphenyl)carbamoylamino]naphthalene-2-carbonyl]amino]acetic acid CAS Name: 2-[[[3-[[(2,6-dimethylanilino)-oxomethyl]amino]-2-naphthalenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[3-[(2,6-dimethylphenyl)carbamoylamino]naphthalene-2-carbonyl]amino]acetic acid Traditional Name: 2-[[3-[(2,6-dimethylphenyl)carbamoylamino]-2-naphthoyl]amino]acetic acid Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O4/c1-13-6-5-7-14(2)20(13)25-22(29)24-18-11-16-9-4-3-8-15(16)10-17(18)21(28)23-12-19(26)27/h3-11H,12H2,1-2H3,(H,23,28)(H,26,27)(H2,24,25,29)