3-[[(3S)-4-methyl-3-(4-propan-2-yloxyphenyl)pentanoyl]amino]propyl-dipropyl-azanium

Systemtic Name: 3-[[(3S)-4-methyl-3-(4-propan-2-yloxyphenyl)pentanoyl]amino]propyl-dipropyl-azanium Openeye Name: 3-[[(3S)-3-(4-isopropoxyphenyl)-4-methyl-pentanoyl]amino]propyl-dipropyl-ammonium CAS Name: 3-[[(3S)-4-methyl-1-oxo-3-(4-propan-2-yloxyphenyl)pentyl]amino]propyl-dipropylammonium IUPAC Name: 3-[[(3S)-4-methyl-3-(4-propan-2-yloxyphenyl)pentanoyl]amino]propyl-dipropylazanium Traditional Name: 3-[[(3S)-3-(4-isopropoxyphenyl)-4-methyl-pentanoyl]amino]propyl-dipropyl-ammonium Formula: C24H43N2O2+ MolecularWeight: 391.61042

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)CCCNC(=O)CC(C1=CC=C(C=C1)OC(C)C)C(C)C

Isomeric SMILES

CCC[NH+](CCC)CCCNC(=O)C[C@H](C1=CC=C(C=C1)OC(C)C)C(C)C

InChI

InChI=1S/C24H42N2O2/c1-7-15-26(16-8-2)17-9-14-25-24(27)18-23(19(3)4)21-10-12-22(13-11-21)28-20(5)6/h10-13,19-20,23H,7-9,14-18H2,1-6H3,(H,25,27)/p+1/t23-/m0/s1