2-chloranyl-N-[(Z)-1-(3-nitrophenyl)-3-oxidanylidene-3-(3-oxidanylpropylamino)prop-1-en-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[(Z)-1-(3-nitrophenyl)-3-oxidanylidene-3-(3-oxidanylpropylamino)prop-1-en-2-yl]benzamide Openeye Name: 2-chloro-N-[(Z)-1-(3-hydroxypropylcarbamoyl)-2-(3-nitrophenyl)vinyl]benzamide CAS Name: 2-chloro-N-[(Z)-3-(3-hydroxypropylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: 2-chloro-N-[(Z)-3-(3-hydroxypropylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: 2-chloro-N-[(Z)-1-(3-hydroxypropylcarbamoyl)-2-(3-nitrophenyl)vinyl]benzamide Formula: C19H18ClN3O5 MolecularWeight: 403.81632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)NCCCO)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/C(=O)NCCCO)Cl

InChI

InChI=1S/C19H18ClN3O5/c20-16-8-2-1-7-15(16)18(25)22-17(19(26)21-9-4-10-24)12-13-5-3-6-14(11-13)23(27)28/h1-3,5-8,11-12,24H,4,9-10H2,(H,21,26)(H,22,25)/b17-12-