methyl 3-[methyl-[(2-piperidin-1-ylphenyl)methyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[methyl-[(2-piperidin-1-ylphenyl)methyl]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[methyl-[[2-(1-piperidyl)phenyl]methyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[methyl-[[2-(1-piperidinyl)phenyl]methyl]amino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[methyl-[(2-piperidin-1-ylphenyl)methyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[methyl-(2-piperidinobenzyl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1N2CCCCC2)C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CN(CC1=CC=CC=C1N2CCCCC2)C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C22H25N3O5/c1-23(15-16-8-4-5-9-20(16)24-10-6-3-7-11-24)21(26)17-12-18(22(27)30-2)14-19(13-17)25(28)29/h4-5,8-9,12-14H,3,6-7,10-11,15H2,1-2H3