N-[4-[2-(ethylamino)-2-oxidanylidene-ethoxy]phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[4-[2-(ethylamino)-2-oxidanylidene-ethoxy]phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[4-[2-(ethylamino)-2-oxo-ethoxy]phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[4-[2-(ethylamino)-2-keto-ethoxy]phenyl]-3-nitro-4-pyrrolidino-benzamide Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)COC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)COC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O5/c1-2-22-20(26)14-30-17-8-6-16(7-9-17)23-21(27)15-5-10-18(19(13-15)25(28)29)24-11-3-4-12-24/h5-10,13H,2-4,11-12,14H2,1H3,(H,22,26)(H,23,27)