4-methyl-N-[(E)-[4-(2-morpholin-4-ylethylamino)-4-oxidanylidene-butan-2-ylidene]amino]-3-nitro-benzamide

Systemtic Name: 4-methyl-N-[(E)-[4-(2-morpholin-4-ylethylamino)-4-oxidanylidene-butan-2-ylidene]amino]-3-nitro-benzamide Openeye Name: 4-methyl-N-[(E)-[1-methyl-3-(2-morpholinoethylamino)-3-oxo-propylidene]amino]-3-nitro-benzamide CAS Name: 4-methyl-N-[(E)-[4-[2-(4-morpholinyl)ethylamino]-4-oxobutan-2-ylidene]amino]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[(E)-[4-(2-morpholin-4-ylethylamino)-4-oxobutan-2-ylidene]amino]-3-nitrobenzamide Traditional Name: N-[(E)-[3-keto-1-methyl-3-(2-morpholinoethylamino)propylidene]amino]-4-methyl-3-nitro-benzamide Formula: C18H25N5O5 MolecularWeight: 391.4216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NN=C(C)CC(=O)NCCN2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N/N=C(\C)/CC(=O)NCCN2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C18H25N5O5/c1-13-3-4-15(12-16(13)23(26)27)18(25)21-20-14(2)11-17(24)19-5-6-22-7-9-28-10-8-22/h3-4,12H,5-11H2,1-2H3,(H,19,24)(H,21,25)/b20-14+