N-[3-[[3-(hydroxymethyl)phenyl]amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[[3-(hydroxymethyl)phenyl]amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-[3-(hydroxymethyl)anilino]-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[3-(hydroxymethyl)anilino]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-[3-(hydroxymethyl)anilino]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-keto-3-(3-methylolanilino)propyl]-4-nitro-benzamide Formula: C17H17N3O5 MolecularWeight: 343.33398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])CO

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])CO

InChI

InChI=1S/C17H17N3O5/c21-11-12-2-1-3-14(10-12)19-16(22)8-9-18-17(23)13-4-6-15(7-5-13)20(24)25/h1-7,10,21H,8-9,11H2,(H,18,23)(H,19,22)