N-[3-[[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-[[(2R)-2-(2-furyl)-2-pyrrolidin-1-yl-ethyl]amino]-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[[(2R)-2-(2-furanyl)-2-(1-pyrrolidinyl)ethyl]amino]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-[[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-[[(2R)-2-(2-furyl)-2-pyrrolidino-ethyl]amino]-3-keto-propyl]-4-nitro-benzamide Formula: C20H24N4O5 MolecularWeight: 400.42836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CO3

Isomeric SMILES

C1CCN(C1)[C@H](CNC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CO3

InChI

InChI=1S/C20H24N4O5/c25-19(9-10-21-20(26)15-5-7-16(8-6-15)24(27)28)22-14-17(18-4-3-13-29-18)23-11-1-2-12-23/h3-8,13,17H,1-2,9-12,14H2,(H,21,26)(H,22,25)/t17-/m1/s1