[(4R)-5,7-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2,3-dihydrochromen-4-yl]methylazanium

Systemtic Name: [(4R)-5,7-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2,3-dihydrochromen-4-yl]methylazanium Openeye Name: [(4R)-5,7-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)chroman-4-yl]methylammonium CAS Name: [(4R)-5,7-dimethyl-4-(4-methyl-1-piperazin-4-iumyl)-3,4-dihydro-2H-1-benzopyran-4-yl]methylammonium IUPAC Name: [(4R)-5,7-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2,3-dihydrochromen-4-yl]methylazanium Traditional Name: [(4R)-5,7-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)chroman-4-yl]methylammonium Formula: C17H29N3O+2 MolecularWeight: 291.43166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)OCCC2(C[NH3+])N3CC[NH+](CC3)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)OCC[C@@]2(C[NH3+])N3CC[NH+](CC3)C)C

InChI

InChI=1S/C17H27N3O/c1-13-10-14(2)16-15(11-13)21-9-4-17(16,12-18)20-7-5-19(3)6-8-20/h10-11H,4-9,12,18H2,1-3H3/p+2/t17-/m0/s1