[(2S,3S)-1-[[4-(diethylamino)-2-methyl-phenyl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-1-[[4-(diethylamino)-2-methyl-phenyl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S,2S)-1-[[4-(diethylamino)-2-methyl-phenyl]carbamoyl]-2-methyl-butyl]ammonium CAS Name: [(2S,3S)-1-[4-(diethylamino)-2-methylanilino]-3-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S,3S)-1-[4-(diethylamino)-2-methylanilino]-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2S)-1-[[4-(diethylamino)-2-methyl-phenyl]carbamoyl]-2-methyl-butyl]ammonium Formula: C17H30N3O+ MolecularWeight: 292.4396

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=C(C=C(C=C1)N(CC)CC)C)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NC1=C(C=C(C=C1)N(CC)CC)C)[NH3+]

InChI

InChI=1S/C17H29N3O/c1-6-12(4)16(18)17(21)19-15-10-9-14(11-13(15)5)20(7-2)8-3/h9-12,16H,6-8,18H2,1-5H3,(H,19,21)/p+1/t12-,16-/m0/s1