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

Systemtic Name: 5-[methyl-[(2-piperidin-1-ylphenyl)methyl]carbamoyl]-2-nitro-phenolate Openeye Name: 5-[methyl-[[2-(1-piperidyl)phenyl]methyl]carbamoyl]-2-nitro-phenolate CAS Name: 5-[[methyl-[[2-(1-piperidinyl)phenyl]methyl]amino]-oxomethyl]-2-nitrophenolate IUPAC Name: 5-[methyl-[(2-piperidin-1-ylphenyl)methyl]carbamoyl]-2-nitrophenolate Traditional Name: 5-[methyl-(2-piperidinobenzyl)carbamoyl]-2-nitro-phenolate Formula: C20H22N3O4- MolecularWeight: 368.40638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O4/c1-21(20(25)15-9-10-18(23(26)27)19(24)13-15)14-16-7-3-4-8-17(16)22-11-5-2-6-12-22/h3-4,7-10,13,24H,2,5-6,11-12,14H2,1H3/p-1