diethyl-[(4S)-4-[(3-methylphenyl)methylazaniumyl]pentyl]azanium

Systemtic Name: diethyl-[(4S)-4-[(3-methylphenyl)methylazaniumyl]pentyl]azanium Openeye Name: diethyl-[(4S)-4-(m-tolylmethylammonio)pentyl]ammonium CAS Name: diethyl-[(4S)-4-[(3-methylphenyl)methylammonio]pentyl]ammonium IUPAC Name: diethyl-[(4S)-4-[(3-methylphenyl)methylazaniumyl]pentyl]azanium Traditional Name: diethyl-[(4S)-4-[(3-methylbenzyl)ammonio]pentyl]ammonium Formula: C17H32N2+2 MolecularWeight: 264.44938

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)[NH2+]CC1=CC=CC(=C1)C

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)[NH2+]CC1=CC=CC(=C1)C

InChI

InChI=1S/C17H30N2/c1-5-19(6-2)12-8-10-16(4)18-14-17-11-7-9-15(3)13-17/h7,9,11,13,16,18H,5-6,8,10,12,14H2,1-4H3/p+2/t16-/m0/s1