3-oxidanylidene-4-(3-phenylpropyl)-1,4-benzoxazine-7-carboxylate

Systemtic Name: 3-oxidanylidene-4-(3-phenylpropyl)-1,4-benzoxazine-7-carboxylate Openeye Name: 3-oxo-4-(3-phenylpropyl)-1,4-benzoxazine-7-carboxylate CAS Name: 3-oxo-4-(3-phenylpropyl)-1,4-benzoxazine-7-carboxylate IUPAC Name: 3-oxo-4-(3-phenylpropyl)-1,4-benzoxazine-7-carboxylate Traditional Name: 3-keto-4-(3-phenylpropyl)-1,4-benzoxazine-7-carboxylate Formula: C18H16NO4- MolecularWeight: 310.32394

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=C(C=C2)C(=O)[O-])CCCC3=CC=CC=C3

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=C(C=C2)C(=O)[O-])CCCC3=CC=CC=C3

InChI

InChI=1S/C18H17NO4/c20-17-12-23-16-11-14(18(21)22)8-9-15(16)19(17)10-4-7-13-5-2-1-3-6-13/h1-3,5-6,8-9,11H,4,7,10,12H2,(H,21,22)/p-1