N-[3-azanyl-1-[3-nitro-4-(propan-2-ylamino)phenyl]-3-oxidanylidene-propyl]-2,5-dimethoxy-benzamide

Systemtic Name: N-[3-azanyl-1-[3-nitro-4-(propan-2-ylamino)phenyl]-3-oxidanylidene-propyl]-2,5-dimethoxy-benzamide Openeye Name: N-[3-amino-1-[4-(isopropylamino)-3-nitro-phenyl]-3-oxo-propyl]-2,5-dimethoxy-benzamide CAS Name: N-[3-amino-1-[3-nitro-4-(propan-2-ylamino)phenyl]-3-oxopropyl]-2,5-dimethoxybenzamide IUPAC Name: N-[3-amino-1-[3-nitro-4-(propan-2-ylamino)phenyl]-3-oxopropyl]-2,5-dimethoxybenzamide Traditional Name: N-[3-amino-1-[4-(isopropylamino)-3-nitro-phenyl]-3-keto-propyl]-2,5-dimethoxy-benzamide Formula: C21H26N4O6 MolecularWeight: 430.45434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(C=C(C=C1)C(CC(=O)N)NC(=O)C2=C(C=CC(=C2)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC1=C(C=C(C=C1)C(CC(=O)N)NC(=O)C2=C(C=CC(=C2)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O6/c1-12(2)23-16-7-5-13(9-18(16)25(28)29)17(11-20(22)26)24-21(27)15-10-14(30-3)6-8-19(15)31-4/h5-10,12,17,23H,11H2,1-4H3,(H2,22,26)(H,24,27)