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

Systemtic Name: phenyl 6-(2-azanylethylcarbamoyl)-2-(2-methylpropyl)-3-oxidanylidene-2,4-dihydroquinoxaline-1-carboxylate Openeye Name: phenyl 6-(2-aminoethylcarbamoyl)-2-isobutyl-3-oxo-2,4-dihydroquinoxaline-1-carboxylate CAS Name: 6-[(2-aminoethylamino)-oxomethyl]-2-(2-methylpropyl)-3-oxo-2,4-dihydroquinoxaline-1-carboxylic acid phenyl ester IUPAC Name: phenyl 6-(2-aminoethylcarbamoyl)-2-(2-methylpropyl)-3-oxo-2,4-dihydroquinoxaline-1-carboxylate Traditional Name: 6-(2-aminoethylcarbamoyl)-2-isobutyl-3-keto-2,4-dihydroquinoxaline-1-carboxylic acid phenyl ester Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)NC2=C(N1C(=O)OC3=CC=CC=C3)C=CC(=C2)C(=O)NCCN

Isomeric SMILES

CC(C)CC1C(=O)NC2=C(N1C(=O)OC3=CC=CC=C3)C=CC(=C2)C(=O)NCCN

InChI

InChI=1S/C22H26N4O4/c1-14(2)12-19-21(28)25-17-13-15(20(27)24-11-10-23)8-9-18(17)26(19)22(29)30-16-6-4-3-5-7-16/h3-9,13-14,19H,10-12,23H2,1-2H3,(H,24,27)(H,25,28)