[3-[(3-chlorophenyl)-(pyridin-4-ylmethyl)amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[(3-chlorophenyl)-(pyridin-4-ylmethyl)amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[3-chloro-N-(4-pyridylmethyl)anilino]-3-oxo-propyl]ammonium CAS Name: [3-[3-chloro-N-(pyridin-4-ylmethyl)anilino]-3-oxopropyl]ammonium IUPAC Name: [3-[3-chloro-N-(pyridin-4-ylmethyl)anilino]-3-oxopropyl]azanium Traditional Name: [3-[3-chloro-N-(4-pyridylmethyl)anilino]-3-keto-propyl]ammonium Formula: C15H17ClN3O+ MolecularWeight: 290.76798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)N(CC2=CC=NC=C2)C(=O)CC[NH3+]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)N(CC2=CC=NC=C2)C(=O)CC[NH3+]

InChI

InChI=1S/C15H16ClN3O/c16-13-2-1-3-14(10-13)19(15(20)4-7-17)11-12-5-8-18-9-6-12/h1-3,5-6,8-10H,4,7,11,17H2/p+1