3-[2-(4-chlorophenyl)ethanoylamino]-3-[3-nitro-4-(2-phenoxyethylamino)phenyl]propanamide

Systemtic Name: 3-[2-(4-chlorophenyl)ethanoylamino]-3-[3-nitro-4-(2-phenoxyethylamino)phenyl]propanamide Openeye Name: 3-[[2-(4-chlorophenyl)acetyl]amino]-3-[3-nitro-4-(2-phenoxyethylamino)phenyl]propanamide CAS Name: 3-[[2-(4-chlorophenyl)-1-oxoethyl]amino]-3-[3-nitro-4-(2-phenoxyethylamino)phenyl]propanamide IUPAC Name: 3-[[2-(4-chlorophenyl)acetyl]amino]-3-[3-nitro-4-(2-phenoxyethylamino)phenyl]propanamide Traditional Name: 3-[[2-(4-chlorophenyl)acetyl]amino]-3-[3-nitro-4-(2-phenoxyethylamino)phenyl]propionamide Formula: C25H25ClN4O5 MolecularWeight: 496.9428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCNC2=C(C=C(C=C2)C(CC(=O)N)NC(=O)CC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCNC2=C(C=C(C=C2)C(CC(=O)N)NC(=O)CC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C25H25ClN4O5/c26-19-9-6-17(7-10-19)14-25(32)29-22(16-24(27)31)18-8-11-21(23(15-18)30(33)34)28-12-13-35-20-4-2-1-3-5-20/h1-11,15,22,28H,12-14,16H2,(H2,27,31)(H,29,32)