N-(2-azanylethyl)-1-(4-nitrophenyl)carbonyl-3-oxidanylidene-2-propan-2-yl-2,4-dihydroquinoxaline-6-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(4-nitrophenyl)carbonyl-3-oxidanylidene-2-propan-2-yl-2,4-dihydroquinoxaline-6-carboxamide Openeye Name: N-(2-aminoethyl)-2-isopropyl-1-(4-nitrobenzoyl)-3-oxo-2,4-dihydroquinoxaline-6-carboxamide CAS Name: N-(2-aminoethyl)-1-[(4-nitrophenyl)-oxomethyl]-3-oxo-2-propan-2-yl-2,4-dihydroquinoxaline-6-carboxamide IUPAC Name: N-(2-aminoethyl)-1-(4-nitrobenzoyl)-3-oxo-2-propan-2-yl-2,4-dihydroquinoxaline-6-carboxamide Traditional Name: N-(2-aminoethyl)-2-isopropyl-3-keto-1-(4-nitrobenzoyl)-2,4-dihydroquinoxaline-6-carboxamide Formula: C21H23N5O5 MolecularWeight: 425.43782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)NC2=C(N1C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C=CC(=C2)C(=O)NCCN

Isomeric SMILES

CC(C)C1C(=O)NC2=C(N1C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C=CC(=C2)C(=O)NCCN

InChI

InChI=1S/C21H23N5O5/c1-12(2)18-20(28)24-16-11-14(19(27)23-10-9-22)5-8-17(16)25(18)21(29)13-3-6-15(7-4-13)26(30)31/h3-8,11-12,18H,9-10,22H2,1-2H3,(H,23,27)(H,24,28)