N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[2-(2-bromoanilino)-2-oxo-ethyl]-N-methyl-2-morpholino-5-nitro-benzamide CAS Name: N-[2-(2-bromoanilino)-2-oxoethyl]-N-methyl-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[2-(2-bromoanilino)-2-oxoethyl]-N-methyl-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[2-(2-bromoanilino)-2-keto-ethyl]-N-methyl-2-morpholino-5-nitro-benzamide Formula: C20H21BrN4O5 MolecularWeight: 477.30854

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1Br)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1Br)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C20H21BrN4O5/c1-23(13-19(26)22-17-5-3-2-4-16(17)21)20(27)15-12-14(25(28)29)6-7-18(15)24-8-10-30-11-9-24/h2-7,12H,8-11,13H2,1H3,(H,22,26)