N'-(4-methyl-2-nitro-phenyl)-N-[(4-phenyloxan-4-yl)methyl]ethanediamide

Systemtic Name: N'-(4-methyl-2-nitro-phenyl)-N-[(4-phenyloxan-4-yl)methyl]ethanediamide Openeye Name: N'-(4-methyl-2-nitro-phenyl)-N-[(4-phenyltetrahydropyran-4-yl)methyl]oxamide CAS Name: N'-(4-methyl-2-nitrophenyl)-N-[(4-phenyl-4-oxanyl)methyl]oxamide IUPAC Name: N'-(4-methyl-2-nitrophenyl)-N-[(4-phenyloxan-4-yl)methyl]oxamide Traditional Name: N'-(4-methyl-2-nitro-phenyl)-N-[(4-phenyltetrahydropyran-4-yl)methyl]oxamide Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(=O)NCC2(CCOCC2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(=O)NCC2(CCOCC2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O5/c1-15-7-8-17(18(13-15)24(27)28)23-20(26)19(25)22-14-21(9-11-29-12-10-21)16-5-3-2-4-6-16/h2-8,13H,9-12,14H2,1H3,(H,22,25)(H,23,26)