N-[2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[2-(2-furyl)-2-pyrrolidin-1-yl-ethyl]-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[2-(2-furanyl)-2-(1-pyrrolidinyl)ethyl]-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[2-(2-furyl)-2-pyrrolidino-ethyl]-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C23H30N4O4 MolecularWeight: 426.5087

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NCC(C3=CC=CO3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NCC(C3=CC=CO3)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H30N4O4/c1-17-6-4-12-26(16-17)19-9-8-18(14-20(19)27(29)30)23(28)24-15-21(22-7-5-13-31-22)25-10-2-3-11-25/h5,7-9,13-14,17,21H,2-4,6,10-12,15-16H2,1H3,(H,24,28)