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

Systemtic Name: 4-methyl-N-[(Z)-[4-(2-morpholin-4-ium-4-ylethylamino)-4-oxidanylidene-butan-2-ylidene]amino]-3-nitro-benzamide Openeye Name: 4-methyl-N-[(Z)-[1-methyl-3-(2-morpholin-4-ium-4-ylethylamino)-3-oxo-propylidene]amino]-3-nitro-benzamide CAS Name: 4-methyl-N-[(Z)-[4-[2-(4-morpholin-4-iumyl)ethylamino]-4-oxobutan-2-ylidene]amino]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[(Z)-[4-(2-morpholin-4-ium-4-ylethylamino)-4-oxobutan-2-ylidene]amino]-3-nitrobenzamide Traditional Name: N-[(Z)-[3-keto-1-methyl-3-(2-morpholin-4-ium-4-ylethylamino)propylidene]amino]-4-methyl-3-nitro-benzamide Formula: C18H26N5O5+ MolecularWeight: 392.42954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NN=C(C)CC(=O)NCC[NH+]2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N/N=C(/C)\CC(=O)NCC[NH+]2CCOCC2)[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)/p+1/b20-14-