3-nitro-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-nitro-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[1-(2-anilino-2-oxo-ethyl)-4-piperidyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[1-(2-anilino-2-oxoethyl)-4-piperidinyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[1-(2-anilino-2-keto-ethyl)-4-piperidyl]-3-nitro-4-pyrrolidino-benzamide Formula: C24H29N5O4 MolecularWeight: 451.51816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3CCN(CC3)CC(=O)NC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3CCN(CC3)CC(=O)NC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H29N5O4/c30-23(25-19-6-2-1-3-7-19)17-27-14-10-20(11-15-27)26-24(31)18-8-9-21(22(16-18)29(32)33)28-12-4-5-13-28/h1-3,6-9,16,20H,4-5,10-15,17H2,(H,25,30)(H,26,31)