methyl 2-[[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]amino]-5-nitro-benzoate

Systemtic Name: methyl 2-[[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]amino]-5-nitro-benzoate Openeye Name: methyl 2-[[2-(2-furyl)-2-(1-piperidyl)ethyl]amino]-5-nitro-benzoate CAS Name: 2-[[2-(2-furanyl)-2-(1-piperidinyl)ethyl]amino]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-5-nitrobenzoate Traditional Name: 2-[[2-(2-furyl)-2-piperidino-ethyl]amino]-5-nitro-benzoic acid methyl ester Formula: C19H23N3O5 MolecularWeight: 373.40302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NCC(C2=CC=CO2)N3CCCCC3

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NCC(C2=CC=CO2)N3CCCCC3

InChI

InChI=1S/C19H23N3O5/c1-26-19(23)15-12-14(22(24)25)7-8-16(15)20-13-17(18-6-5-11-27-18)21-9-3-2-4-10-21/h5-8,11-12,17,20H,2-4,9-10,13H2,1H3