[(2R)-4-[(2-methoxyphenyl)amino]-4-oxidanylidene-butan-2-yl]-(4-oxidanylcyclohexyl)azanium

Systemtic Name: [(2R)-4-[(2-methoxyphenyl)amino]-4-oxidanylidene-butan-2-yl]-(4-oxidanylcyclohexyl)azanium Openeye Name: (4-hydroxycyclohexyl)-[(1R)-3-(2-methoxyanilino)-1-methyl-3-oxo-propyl]ammonium CAS Name: (4-hydroxycyclohexyl)-[(2R)-4-(2-methoxyanilino)-4-oxobutan-2-yl]ammonium IUPAC Name: (4-hydroxycyclohexyl)-[(2R)-4-(2-methoxyanilino)-4-oxobutan-2-yl]azanium Traditional Name: (4-hydroxycyclohexyl)-[(1R)-3-keto-1-methyl-3-(o-anisidino)propyl]ammonium Formula: C17H27N2O3+ MolecularWeight: 307.40788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC=CC=C1OC)[NH2+]C2CCC(CC2)O

Isomeric SMILES

C[C@H](CC(=O)NC1=CC=CC=C1OC)[NH2+]C2CCC(CC2)O

InChI

InChI=1S/C17H26N2O3/c1-12(18-13-7-9-14(20)10-8-13)11-17(21)19-15-5-3-4-6-16(15)22-2/h3-6,12-14,18,20H,7-11H2,1-2H3,(H,19,21)/p+1/t12-,13?,14?/m1/s1