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

Systemtic Name: N-[3-azanyl-1-[3-nitro-4-(2-pyrrolidin-1-ylethylamino)phenyl]-3-oxidanylidene-propyl]-2,5-dimethoxy-benzamide Openeye Name: N-[3-amino-1-[3-nitro-4-(2-pyrrolidin-1-ylethylamino)phenyl]-3-oxo-propyl]-2,5-dimethoxy-benzamide CAS Name: N-[3-amino-1-[3-nitro-4-[2-(1-pyrrolidinyl)ethylamino]phenyl]-3-oxopropyl]-2,5-dimethoxybenzamide IUPAC Name: N-[3-amino-1-[3-nitro-4-(2-pyrrolidin-1-ylethylamino)phenyl]-3-oxopropyl]-2,5-dimethoxybenzamide Traditional Name: N-[3-amino-3-keto-1-[3-nitro-4-(2-pyrrolidinoethylamino)phenyl]propyl]-2,5-dimethoxy-benzamide Formula: C24H31N5O6 MolecularWeight: 485.53284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)NC(CC(=O)N)C2=CC(=C(C=C2)NCCN3CCCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)NC(CC(=O)N)C2=CC(=C(C=C2)NCCN3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C24H31N5O6/c1-34-17-6-8-22(35-2)18(14-17)24(31)27-20(15-23(25)30)16-5-7-19(21(13-16)29(32)33)26-9-12-28-10-3-4-11-28/h5-8,13-14,20,26H,3-4,9-12,15H2,1-2H3,(H2,25,30)(H,27,31)