4-chloranyl-3-(piperidin-1-ium-1-ylmethyl)chromen-2-one

Systemtic Name: 4-chloranyl-3-(piperidin-1-ium-1-ylmethyl)chromen-2-one Openeye Name: 4-chloro-3-(piperidin-1-ium-1-ylmethyl)chromen-2-one CAS Name: 4-chloro-3-(1-piperidin-1-iumylmethyl)-1-benzopyran-2-one IUPAC Name: 4-chloro-3-(piperidin-1-ium-1-ylmethyl)chromen-2-one Traditional Name: 4-chloro-3-(piperidin-1-ium-1-ylmethyl)coumarin Formula: C15H17ClNO2+ MolecularWeight: 278.75398

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=C(C3=CC=CC=C3OC2=O)Cl

Isomeric SMILES

C1CC[NH+](CC1)CC2=C(C3=CC=CC=C3OC2=O)Cl

InChI

InChI=1S/C15H16ClNO2/c16-14-11-6-2-3-7-13(11)19-15(18)12(14)10-17-8-4-1-5-9-17/h2-3,6-7H,1,4-5,8-10H2/p+1