[3-[(4-chloranyl-2-methyl-phenyl)-(pyridin-4-ylmethyl)amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[(4-chloranyl-2-methyl-phenyl)-(pyridin-4-ylmethyl)amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[4-chloro-2-methyl-N-(4-pyridylmethyl)anilino]-3-oxo-propyl]ammonium CAS Name: [3-[4-chloro-2-methyl-N-(pyridin-4-ylmethyl)anilino]-3-oxopropyl]ammonium IUPAC Name: [3-[4-chloro-2-methyl-N-(pyridin-4-ylmethyl)anilino]-3-oxopropyl]azanium Traditional Name: [3-[4-chloro-2-methyl-N-(4-pyridylmethyl)anilino]-3-keto-propyl]ammonium Formula: C16H19ClN3O+ MolecularWeight: 304.79456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)N(CC2=CC=NC=C2)C(=O)CC[NH3+]

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)N(CC2=CC=NC=C2)C(=O)CC[NH3+]

InChI

InChI=1S/C16H18ClN3O/c1-12-10-14(17)2-3-15(12)20(16(21)4-7-18)11-13-5-8-19-9-6-13/h2-3,5-6,8-10H,4,7,11,18H2,1H3/p+1