3-[4-(4-pentanoylpiperazin-1-yl)phenyl]propylazanium

Systemtic Name: 3-[4-(4-pentanoylpiperazin-1-yl)phenyl]propylazanium Openeye Name: 3-[4-(4-pentanoylpiperazin-1-yl)phenyl]propylammonium CAS Name: 3-[4-[4-(1-oxopentyl)-1-piperazinyl]phenyl]propylammonium IUPAC Name: 3-[4-(4-pentanoylpiperazin-1-yl)phenyl]propylazanium Traditional Name: 3-[4-(4-valerylpiperazino)phenyl]propylammonium Formula: C18H30N3O+ MolecularWeight: 304.4503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)CCC[NH3+]

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)CCC[NH3+]

InChI

InChI=1S/C18H29N3O/c1-2-3-6-18(22)21-14-12-20(13-15-21)17-9-7-16(8-10-17)5-4-11-19/h7-10H,2-6,11-15,19H2,1H3/p+1