4-oxidanylidene-4-[(2-phenyl-1,3-benzoxazol-6-yl)amino]butanoate

Systemtic Name: 4-oxidanylidene-4-[(2-phenyl-1,3-benzoxazol-6-yl)amino]butanoate Openeye Name: 4-oxo-4-[(2-phenyl-1,3-benzoxazol-6-yl)amino]butanoate CAS Name: 4-oxo-4-[(2-phenyl-1,3-benzoxazol-6-yl)amino]butanoate IUPAC Name: 4-oxo-4-[(2-phenyl-1,3-benzoxazol-6-yl)amino]butanoate Traditional Name: 4-keto-4-[(2-phenyl-1,3-benzoxazol-6-yl)amino]butyrate Formula: C17H13N2O4- MolecularWeight: 309.29612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(O2)C=C(C=C3)NC(=O)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(O2)C=C(C=C3)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C17H14N2O4/c20-15(8-9-16(21)22)18-12-6-7-13-14(10-12)23-17(19-13)11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H,18,20)(H,21,22)/p-1