N-[3-azanyl-1-[3-nitro-4-(propan-2-ylamino)phenyl]-3-oxidanylidene-propyl]benzamide

Systemtic Name: N-[3-azanyl-1-[3-nitro-4-(propan-2-ylamino)phenyl]-3-oxidanylidene-propyl]benzamide Openeye Name: N-[3-amino-1-[4-(isopropylamino)-3-nitro-phenyl]-3-oxo-propyl]benzamide CAS Name: N-[3-amino-1-[3-nitro-4-(propan-2-ylamino)phenyl]-3-oxopropyl]benzamide IUPAC Name: N-[3-amino-1-[3-nitro-4-(propan-2-ylamino)phenyl]-3-oxopropyl]benzamide Traditional Name: N-[3-amino-1-[4-(isopropylamino)-3-nitro-phenyl]-3-keto-propyl]benzamide Formula: C19H22N4O4 MolecularWeight: 370.40238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(C=C(C=C1)C(CC(=O)N)NC(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC1=C(C=C(C=C1)C(CC(=O)N)NC(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4/c1-12(2)21-15-9-8-14(10-17(15)23(26)27)16(11-18(20)24)22-19(25)13-6-4-3-5-7-13/h3-10,12,16,21H,11H2,1-2H3,(H2,20,24)(H,22,25)