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

Systemtic Name: N-[3-azanyl-1-[4-(cyclopropylmethylamino)-3-nitro-phenyl]-3-oxidanylidene-propyl]-2,5-dimethoxy-benzamide Openeye Name: N-[3-amino-1-[4-(cyclopropylmethylamino)-3-nitro-phenyl]-3-oxo-propyl]-2,5-dimethoxy-benzamide CAS Name: N-[3-amino-1-[4-(cyclopropylmethylamino)-3-nitrophenyl]-3-oxopropyl]-2,5-dimethoxybenzamide IUPAC Name: N-[3-amino-1-[4-(cyclopropylmethylamino)-3-nitrophenyl]-3-oxopropyl]-2,5-dimethoxybenzamide Traditional Name: N-[3-amino-1-[4-(cyclopropylmethylamino)-3-nitro-phenyl]-3-keto-propyl]-2,5-dimethoxy-benzamide Formula: C22H26N4O6 MolecularWeight: 442.46504

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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)NCC3CC3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)NC(CC(=O)N)C2=CC(=C(C=C2)NCC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O6/c1-31-15-6-8-20(32-2)16(10-15)22(28)25-18(11-21(23)27)14-5-7-17(19(9-14)26(29)30)24-12-13-3-4-13/h5-10,13,18,24H,3-4,11-12H2,1-2H3,(H2,23,27)(H,25,28)