[3-[[(2S)-butan-2-yl]-[(4-propan-2-ylphenyl)methyl]amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[[(2S)-butan-2-yl]-[(4-propan-2-ylphenyl)methyl]amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[(4-isopropylphenyl)methyl-[(1S)-1-methylpropyl]amino]-3-oxo-propyl]ammonium CAS Name: [3-[[(2S)-butan-2-yl]-[(4-propan-2-ylphenyl)methyl]amino]-3-oxopropyl]ammonium IUPAC Name: [3-[[(2S)-butan-2-yl]-[(4-propan-2-ylphenyl)methyl]amino]-3-oxopropyl]azanium Traditional Name: [3-[(4-isopropylbenzyl)-[(1S)-1-methylpropyl]amino]-3-keto-propyl]ammonium Formula: C17H29N2O+ MolecularWeight: 277.42496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=C(C=C1)C(C)C)C(=O)CC[NH3+]

Isomeric SMILES

CC[C@H](C)N(CC1=CC=C(C=C1)C(C)C)C(=O)CC[NH3+]

InChI

InChI=1S/C17H28N2O/c1-5-14(4)19(17(20)10-11-18)12-15-6-8-16(9-7-15)13(2)3/h6-9,13-14H,5,10-12,18H2,1-4H3/p+1/t14-/m0/s1