ethyl 2,4-dimethyl-5-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)carbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[(3-oxo-4H-1,4-benzoxazin-6-yl)carbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[(3-oxo-4H-1,4-benzoxazin-6-yl)amino]methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[(3-oxo-4H-1,4-benzoxazin-6-yl)carbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[(3-keto-4H-1,4-benzoxazin-6-yl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)NC2=CC3=C(C=C2)OCC(=O)N3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)NC2=CC3=C(C=C2)OCC(=O)N3)C

InChI

InChI=1S/C18H19N3O5/c1-4-25-18(24)15-9(2)16(19-10(15)3)17(23)20-11-5-6-13-12(7-11)21-14(22)8-26-13/h5-7,19H,4,8H2,1-3H3,(H,20,23)(H,21,22)