2-ethoxy-N-[(2R)-3-methyl-1-[[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]amino]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-ethoxy-N-[(2R)-3-methyl-1-[[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]amino]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-ethoxy-N-[(1R)-2-methyl-1-[[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]carbamoyl]propyl]benzamide CAS Name: 2-ethoxy-N-[(2R)-3-methyl-1-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)anilino]-1-oxobutan-2-yl]benzamide IUPAC Name: 2-ethoxy-N-[(2R)-3-methyl-1-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)anilino]-1-oxobutan-2-yl]benzamide Traditional Name: 2-ethoxy-N-[(1R)-2-methyl-1-[[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]carbamoyl]propyl]benzamide Formula: C26H37N4O3+ MolecularWeight: 453.59698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)NC2=C(C=C(C=C2)N3CC[NH+](CC3)C)C

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)N[C@H](C(C)C)C(=O)NC2=C(C=C(C=C2)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C26H36N4O3/c1-6-33-23-10-8-7-9-21(23)25(31)28-24(18(2)3)26(32)27-22-12-11-20(17-19(22)4)30-15-13-29(5)14-16-30/h7-12,17-18,24H,6,13-16H2,1-5H3,(H,27,32)(H,28,31)/p+1/t24-/m1/s1