phenyl 6-(2-azanylethylcarbamoyl)-3-oxidanylidene-2-propan-2-yl-2,4-dihydroquinoxaline-1-carboxylate

Systemtic Name: phenyl 6-(2-azanylethylcarbamoyl)-3-oxidanylidene-2-propan-2-yl-2,4-dihydroquinoxaline-1-carboxylate Openeye Name: phenyl 6-(2-aminoethylcarbamoyl)-2-isopropyl-3-oxo-2,4-dihydroquinoxaline-1-carboxylate CAS Name: 6-[(2-aminoethylamino)-oxomethyl]-3-oxo-2-propan-2-yl-2,4-dihydroquinoxaline-1-carboxylic acid phenyl ester IUPAC Name: phenyl 6-(2-aminoethylcarbamoyl)-3-oxo-2-propan-2-yl-2,4-dihydroquinoxaline-1-carboxylate Traditional Name: 6-(2-aminoethylcarbamoyl)-2-isopropyl-3-keto-2,4-dihydroquinoxaline-1-carboxylic acid phenyl ester Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)NC2=C(N1C(=O)OC3=CC=CC=C3)C=CC(=C2)C(=O)NCCN

Isomeric SMILES

CC(C)C1C(=O)NC2=C(N1C(=O)OC3=CC=CC=C3)C=CC(=C2)C(=O)NCCN

InChI

InChI=1S/C21H24N4O4/c1-13(2)18-20(27)24-16-12-14(19(26)23-11-10-22)8-9-17(16)25(18)21(28)29-15-6-4-3-5-7-15/h3-9,12-13,18H,10-11,22H2,1-2H3,(H,23,26)(H,24,27)