[3-(4-pyrazol-1-ylbutanoylamino)phenyl]methylazanium

Systemtic Name: [3-(4-pyrazol-1-ylbutanoylamino)phenyl]methylazanium Openeye Name: [3-(4-pyrazol-1-ylbutanoylamino)phenyl]methylammonium CAS Name: [3-[[1-oxo-4-(1-pyrazolyl)butyl]amino]phenyl]methylammonium IUPAC Name: [3-(4-pyrazol-1-ylbutanoylamino)phenyl]methylazanium Traditional Name: [3-(4-pyrazol-1-ylbutanoylamino)benzyl]ammonium Formula: C14H19N4O+ MolecularWeight: 259.32686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCCN2C=CC=N2)C[NH3+]

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCCN2C=CC=N2)C[NH3+]

InChI

InChI=1S/C14H18N4O/c15-11-12-4-1-5-13(10-12)17-14(19)6-2-8-18-9-3-7-16-18/h1,3-5,7,9-10H,2,6,8,11,15H2,(H,17,19)/p+1