5-[3-(3-methylphenoxy)propylcarbamoyl]-2-nitro-phenolate

Systemtic Name: 5-[3-(3-methylphenoxy)propylcarbamoyl]-2-nitro-phenolate Openeye Name: 5-[3-(3-methylphenoxy)propylcarbamoyl]-2-nitro-phenolate CAS Name: 5-[[3-(3-methylphenoxy)propylamino]-oxomethyl]-2-nitrophenolate IUPAC Name: 5-[3-(3-methylphenoxy)propylcarbamoyl]-2-nitrophenolate Traditional Name: 5-[3-(3-methylphenoxy)propylcarbamoyl]-2-nitro-phenolate Formula: C17H17N2O5- MolecularWeight: 329.32728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCNC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OCCCNC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C17H18N2O5/c1-12-4-2-5-14(10-12)24-9-3-8-18-17(21)13-6-7-15(19(22)23)16(20)11-13/h2,4-7,10-11,20H,3,8-9H2,1H3,(H,18,21)/p-1