(2R)-2-(3-morpholin-4-ylpropylamino)-4-[(3-nitrophenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: (2R)-2-(3-morpholin-4-ylpropylamino)-4-[(3-nitrophenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: (2R)-2-(3-morpholinopropylamino)-4-(3-nitroanilino)-4-oxo-butanoic acid CAS Name: (2R)-2-[3-(4-morpholinyl)propylamino]-4-(3-nitroanilino)-4-oxobutanoic acid IUPAC Name: (2R)-2-(3-morpholin-4-ylpropylamino)-4-(3-nitroanilino)-4-oxobutanoic acid Traditional Name: (2R)-4-keto-2-(3-morpholinopropylamino)-4-(3-nitroanilino)butyric acid Formula: C17H24N4O6 MolecularWeight: 380.39566

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1COCCN1CCCN[C@H](CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H24N4O6/c22-16(19-13-3-1-4-14(11-13)21(25)26)12-15(17(23)24)18-5-2-6-20-7-9-27-10-8-20/h1,3-4,11,15,18H,2,5-10,12H2,(H,19,22)(H,23,24)/t15-/m1/s1