N-[2,6-di(propan-2-yl)phenyl]-4-(2-methoxyethylamino)-3-nitro-benzamide

Systemtic Name: N-[2,6-di(propan-2-yl)phenyl]-4-(2-methoxyethylamino)-3-nitro-benzamide Openeye Name: N-(2,6-diisopropylphenyl)-4-(2-methoxyethylamino)-3-nitro-benzamide CAS Name: N-[2,6-di(propan-2-yl)phenyl]-4-(2-methoxyethylamino)-3-nitrobenzamide IUPAC Name: N-[2,6-di(propan-2-yl)phenyl]-4-(2-methoxyethylamino)-3-nitrobenzamide Traditional Name: N-(2,6-diisopropylphenyl)-4-(2-methoxyethylamino)-3-nitro-benzamide Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O4/c1-14(2)17-7-6-8-18(15(3)4)21(17)24-22(26)16-9-10-19(23-11-12-29-5)20(13-16)25(27)28/h6-10,13-15,23H,11-12H2,1-5H3,(H,24,26)